Literature DB >> 21579929

Bis(2-phenyl-1H-imidazole-κN)silver(I) nitrate.

Shuang Han, Wan-Cheng Li, Dao-Cheng Xia.   

Abstract

The asymmetric unit of the title compound, [Ag(C(9)H(8)N(2))(2)]NO(3), contains one complete [Ag(C(9)H(8)N(2))(2)](+) cation and two half-cations (with the other halves generated through inversion) and two NO(3) (-) anions. Each Ag(I) ion shows a linear AgN(2) coordination. The ions are linked by N-H⋯O hydrogen bonds.

Entities:  

Year:  2009        PMID: 21579929      PMCID: PMC2980267          DOI: 10.1107/S1600536809051459

Source DB:  PubMed          Journal:  Acta Crystallogr Sect E Struct Rep Online        ISSN: 1600-5368


Related literature

For general background to 2-phenyl­imidazole, see: Liu et al. (2008 ▶); Yang et al. (2008 ▶).

Experimental

Crystal data

[Ag(C9H8N2)2]NO3 M = 458.23 Triclinic, a = 9.209 (5) Å b = 9.274 (5) Å c = 23.137 (5) Å α = 88.307 (5)° β = 80.976 (5)° γ = 72.369 (5)° V = 1859.5 (15) Å3 Z = 4 Mo Kα radiation μ = 1.11 mm−1 T = 293 K 0.31 × 0.28 × 0.22 mm

Data collection

Oxford Diffraction Gemini R Ultra diffractometer Absorption correction: multi-scan (CrysAlis; Oxford Diffraction, 2006 ▶) T min = 0.62, T max = 0.86 14127 measured reflections 8475 independent reflections 4372 reflections with I > 2σ(I) R int = 0.029

Refinement

R[F 2 > 2σ(F 2)] = 0.029 wR(F 2) = 0.079 S = 0.80 8475 reflections 490 parameters H-atom parameters constrained Δρmax = 0.28 e Å−3 Δρmin = −0.43 e Å−3 Data collection: CrysAlis (Oxford Diffraction, 2006 ▶); cell refinement: CrysAlis; data reduction: CrysAlis; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 ▶); molecular graphics: SHELXTL (Sheldrick, 2008 ▶); software used to prepare material for publication: SHELXTL. Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536809051459/ci2975sup1.cif Structure factors: contains datablocks I. DOI: 10.1107/S1600536809051459/ci2975Isup2.hkl Additional supplementary materials: crystallographic information; 3D view; checkCIF report
[Ag(C9H8N2)2]NO3Z = 4
Mr = 458.23F(000) = 920
Triclinic, P1Dx = 1.637 Mg m3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 9.209 (5) ÅCell parameters from 8475 reflections
b = 9.274 (5) Åθ = 3.0–29.1°
c = 23.137 (5) ŵ = 1.11 mm1
α = 88.307 (5)°T = 293 K
β = 80.976 (5)°Block, colourless
γ = 72.369 (5)°0.31 × 0.28 × 0.22 mm
V = 1859.5 (15) Å3
Oxford Diffraction Gemini R Ultra diffractometer8475 independent reflections
Radiation source: fine-focus sealed tube4372 reflections with I > 2σ(I)
graphiteRint = 0.029
Detector resolution: 10.0 pixels mm-1θmax = 29.1°, θmin = 1.8°
ω scanh = −10→11
Absorption correction: multi-scan (CrysAlis; Oxford Diffraction, 2006)k = −9→11
Tmin = 0.62, Tmax = 0.86l = −23→28
14127 measured reflections
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.029Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.079H-atom parameters constrained
S = 0.80w = 1/[σ2(Fo2) + (0.04P)2] where P = (Fo2 + 2Fc2)/3
8475 reflections(Δ/σ)max = 0.002
490 parametersΔρmax = 0.28 e Å3
0 restraintsΔρmin = −0.43 e Å3
Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.
Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.
xyzUiso*/Ueq
C10.2039 (4)0.7556 (4)0.48467 (13)0.0638 (9)
H10.26110.81030.46220.077*
C20.0492 (4)0.7985 (3)0.49731 (12)0.0594 (8)
H2A−0.01970.88560.48530.071*
C30.1453 (3)0.5807 (3)0.53886 (11)0.0468 (7)
C40.1492 (3)0.4477 (3)0.57426 (12)0.0519 (7)
C50.2697 (4)0.3145 (4)0.56355 (15)0.0728 (10)
H50.35130.30850.53350.087*
C60.2676 (6)0.1892 (4)0.5984 (2)0.1029 (15)
H6A0.34880.10000.59170.123*
C70.1483 (7)0.1965 (5)0.6419 (2)0.1033 (16)
H7A0.14770.11170.66430.124*
C80.0300 (5)0.3259 (5)0.65292 (16)0.0858 (12)
H8−0.05140.32980.68280.103*
C90.0301 (4)0.4525 (4)0.61976 (13)0.0642 (9)
H9−0.05040.54170.62810.077*
C100.5291 (4)0.3440 (4)0.68802 (15)0.0770 (10)
H100.58540.24730.69760.092*
C110.5840 (4)0.4361 (4)0.65051 (14)0.0703 (9)
H110.68330.41560.62970.084*
C120.3411 (3)0.5502 (4)0.68619 (11)0.0531 (8)
C130.1928 (3)0.6666 (4)0.69513 (12)0.0535 (8)
C140.0864 (4)0.6708 (4)0.74507 (13)0.0675 (9)
H140.11120.59990.77410.081*
C15−0.0549 (4)0.7784 (5)0.75202 (16)0.0831 (11)
H15−0.12550.77930.78560.100*
C16−0.0939 (4)0.8843 (5)0.71036 (19)0.0888 (11)
H16−0.19020.95700.71560.107*
C170.0100 (4)0.8830 (4)0.66062 (16)0.0768 (10)
H17−0.01620.95500.63210.092*
C180.1526 (4)0.7756 (4)0.65282 (13)0.0629 (8)
H180.22250.77560.61910.076*
C19−0.0449 (4)0.2333 (4)0.83247 (15)0.0759 (10)
H19−0.10310.33430.83140.091*
C20−0.0945 (4)0.1228 (4)0.86113 (13)0.0665 (9)
H20−0.19080.13360.88320.080*
C210.1440 (3)0.0264 (4)0.81694 (11)0.0513 (7)
C220.2921 (3)−0.0865 (4)0.79868 (11)0.0513 (7)
C230.3918 (4)−0.0679 (4)0.74913 (12)0.0705 (9)
H230.36140.01700.72630.085*
C240.5334 (4)−0.1714 (5)0.73331 (16)0.0876 (12)
H240.5984−0.15610.70030.105*
C250.5795 (4)−0.2975 (5)0.76602 (19)0.0915 (12)
H250.6758−0.36790.75520.110*
C260.4839 (4)−0.3200 (4)0.81467 (17)0.0835 (11)
H260.5155−0.40610.83680.100*
C270.3413 (4)−0.2161 (4)0.83117 (14)0.0657 (9)
H270.2772−0.23270.86430.079*
C280.3155 (4)0.3721 (4)0.88477 (16)0.0765 (10)
H280.30690.46700.86890.092*
C290.4421 (4)0.2525 (4)0.86556 (14)0.0686 (9)
H290.51990.26680.83720.082*
C300.4548 (3)0.1094 (3)0.88841 (12)0.0566 (8)
H300.54040.02780.87510.068*
C310.3391 (3)0.0887 (3)0.93131 (11)0.0431 (7)
C320.2134 (3)0.2126 (3)0.94971 (12)0.0564 (8)
H320.13490.20030.97820.068*
C330.2016 (4)0.3536 (4)0.92696 (15)0.0708 (9)
H330.11660.43580.94020.085*
C340.3518 (3)−0.0615 (3)0.95527 (11)0.0417 (6)
C350.4571 (3)−0.2971 (3)0.97852 (14)0.0644 (9)
H350.5294−0.38990.98310.077*
C360.3034 (3)−0.2594 (3)0.99545 (13)0.0617 (8)
H360.2506−0.32341.01390.074*
O10.2835 (2)0.3113 (3)0.41706 (10)0.0778 (7)
O20.5143 (3)0.1699 (3)0.41170 (11)0.0944 (8)
O30.3276 (3)0.0750 (3)0.43228 (14)0.1103 (10)
O40.1720 (3)0.3963 (3)1.08721 (12)0.0926 (8)
O50.2200 (2)0.1559 (2)1.09430 (9)0.0675 (6)
O6−0.0137 (2)0.2969 (3)1.10375 (11)0.0854 (8)
Ag10.00000.00001.00000.05936 (11)
Ag20.23738 (3)0.30005 (3)0.759780 (12)0.08314 (12)
Ag30.50000.50000.50000.07317 (13)
N10.1033 (3)0.1731 (3)0.80549 (10)0.0642 (7)
N20.0241 (3)−0.0054 (3)0.85106 (10)0.0574 (7)
H20.0239−0.09310.86410.069*
N30.4853 (2)−0.1724 (2)0.95343 (9)0.0512 (6)
H30.5747−0.16560.93870.061*
N40.2370 (2)−0.1122 (3)0.98131 (10)0.0518 (6)
N50.3783 (3)0.4142 (3)0.70973 (11)0.0650 (7)
N60.4661 (3)0.5638 (3)0.64922 (10)0.0579 (7)
H60.46930.64150.62840.069*
N70.0144 (3)0.6876 (3)0.53138 (10)0.0513 (6)
H7−0.07710.68630.54580.062*
N80.2649 (2)0.6190 (3)0.50983 (10)0.0574 (6)
N90.3743 (3)0.1830 (3)0.42040 (11)0.0659 (7)
N100.1257 (3)0.2861 (3)1.09532 (10)0.0595 (7)
U11U22U33U12U13U23
C10.058 (2)0.064 (2)0.069 (2)−0.0259 (18)0.0022 (16)0.0091 (17)
C20.059 (2)0.045 (2)0.074 (2)−0.0155 (16)−0.0115 (15)0.0133 (16)
C30.0399 (17)0.0372 (18)0.0618 (17)−0.0096 (14)−0.0072 (13)−0.0040 (14)
C40.0543 (19)0.040 (2)0.0655 (18)−0.0133 (16)−0.0252 (15)0.0029 (15)
C50.071 (2)0.052 (2)0.093 (2)−0.004 (2)−0.0319 (18)−0.0003 (19)
C60.116 (4)0.042 (3)0.156 (4)−0.002 (2)−0.082 (3)0.006 (3)
C70.134 (4)0.079 (4)0.135 (4)−0.059 (3)−0.091 (3)0.049 (3)
C80.094 (3)0.088 (3)0.099 (3)−0.050 (3)−0.047 (2)0.043 (2)
C90.058 (2)0.057 (2)0.085 (2)−0.0246 (17)−0.0236 (17)0.0221 (17)
C100.071 (2)0.058 (2)0.097 (3)−0.016 (2)−0.011 (2)0.019 (2)
C110.056 (2)0.064 (3)0.088 (2)−0.021 (2)0.0027 (17)0.0080 (19)
C120.059 (2)0.058 (2)0.0521 (17)−0.0357 (17)−0.0021 (14)0.0015 (15)
C130.056 (2)0.059 (2)0.0558 (18)−0.0344 (17)−0.0035 (14)−0.0080 (15)
C140.064 (2)0.081 (3)0.065 (2)−0.035 (2)−0.0042 (16)−0.0037 (17)
C150.060 (2)0.107 (3)0.083 (3)−0.034 (2)0.0069 (19)−0.016 (2)
C160.055 (2)0.086 (3)0.123 (3)−0.018 (2)−0.010 (2)−0.016 (3)
C170.069 (3)0.072 (3)0.094 (3)−0.025 (2)−0.020 (2)0.008 (2)
C180.068 (2)0.064 (2)0.064 (2)−0.0339 (19)−0.0061 (16)0.0019 (17)
C190.066 (2)0.055 (2)0.101 (3)−0.0134 (19)−0.0087 (19)0.0177 (19)
C200.050 (2)0.062 (2)0.083 (2)−0.0173 (18)0.0016 (16)0.0118 (18)
C210.057 (2)0.059 (2)0.0456 (16)−0.0307 (17)−0.0069 (13)0.0079 (14)
C220.0530 (19)0.058 (2)0.0516 (17)−0.0299 (17)−0.0055 (14)−0.0022 (15)
C230.066 (2)0.095 (3)0.0609 (19)−0.044 (2)−0.0032 (16)0.0005 (18)
C240.065 (3)0.125 (4)0.078 (2)−0.046 (3)0.0149 (19)−0.022 (2)
C250.056 (2)0.107 (4)0.110 (3)−0.027 (2)0.005 (2)−0.035 (3)
C260.063 (3)0.069 (3)0.120 (3)−0.022 (2)−0.010 (2)−0.009 (2)
C270.056 (2)0.063 (2)0.081 (2)−0.0279 (18)−0.0015 (17)−0.0055 (19)
C280.076 (3)0.047 (2)0.109 (3)−0.017 (2)−0.031 (2)0.032 (2)
C290.059 (2)0.071 (3)0.082 (2)−0.030 (2)−0.0148 (17)0.0322 (19)
C300.0407 (17)0.049 (2)0.077 (2)−0.0118 (14)−0.0063 (14)0.0159 (16)
C310.0390 (16)0.0395 (18)0.0511 (15)−0.0099 (14)−0.0129 (12)0.0071 (13)
C320.0510 (19)0.045 (2)0.0669 (19)−0.0067 (16)−0.0083 (14)0.0102 (15)
C330.065 (2)0.041 (2)0.100 (3)−0.0046 (17)−0.0170 (19)0.0077 (18)
C340.0305 (15)0.0371 (18)0.0542 (16)−0.0063 (13)−0.0048 (12)0.0033 (13)
C350.0461 (19)0.0358 (19)0.103 (2)−0.0060 (14)−0.0025 (16)0.0210 (17)
C360.0428 (18)0.046 (2)0.091 (2)−0.0145 (15)0.0043 (15)0.0176 (17)
O10.0471 (13)0.0577 (16)0.1129 (17)−0.0039 (12)0.0063 (12)0.0224 (13)
O20.0428 (14)0.0719 (18)0.153 (2)−0.0084 (12)0.0064 (13)0.0407 (15)
O30.0750 (18)0.0600 (18)0.187 (3)−0.0273 (14)0.0146 (17)0.0236 (17)
O40.0644 (16)0.0526 (16)0.157 (2)−0.0223 (13)0.0026 (15)0.0102 (15)
O50.0415 (12)0.0481 (15)0.0978 (15)−0.0010 (11)0.0055 (10)0.0192 (12)
O60.0352 (13)0.0696 (17)0.137 (2)−0.0074 (11)0.0056 (12)0.0374 (14)
Ag10.03255 (18)0.0589 (2)0.0786 (2)−0.00828 (15)0.00271 (14)0.00923 (17)
Ag20.0825 (2)0.0775 (2)0.1007 (2)−0.04617 (16)−0.00935 (15)0.03293 (16)
Ag30.0386 (2)0.0909 (3)0.0795 (2)−0.00848 (19)0.00153 (16)−0.0079 (2)
N10.0682 (18)0.059 (2)0.0698 (16)−0.0283 (15)−0.0077 (13)0.0195 (14)
N20.0552 (16)0.0504 (18)0.0674 (15)−0.0230 (14)0.0002 (12)0.0116 (13)
N30.0310 (13)0.0396 (15)0.0779 (16)−0.0079 (11)−0.0003 (11)0.0112 (12)
N40.0344 (13)0.0409 (16)0.0744 (15)−0.0085 (11)0.0008 (11)0.0086 (12)
N50.0680 (19)0.0603 (19)0.0721 (17)−0.0312 (15)−0.0063 (13)0.0172 (14)
N60.0583 (16)0.0553 (18)0.0618 (15)−0.0250 (15)0.0004 (12)0.0073 (12)
N70.0363 (13)0.0416 (15)0.0731 (15)−0.0106 (12)−0.0039 (11)0.0087 (12)
N80.0415 (14)0.0541 (18)0.0722 (16)−0.0119 (12)−0.0005 (12)−0.0007 (13)
N90.0483 (17)0.060 (2)0.0818 (18)−0.0153 (16)0.0076 (13)0.0171 (15)
N100.0461 (17)0.053 (2)0.0703 (16)−0.0096 (15)0.0040 (12)0.0136 (13)
C1—C21.344 (4)C22—C271.392 (4)
C1—N81.374 (4)C22—C231.393 (4)
C1—H10.93C23—C241.367 (5)
C2—N71.362 (3)C23—H230.93
C2—H2A0.93C24—C251.367 (5)
C3—N81.335 (3)C24—H240.93
C3—N71.340 (3)C25—C261.368 (5)
C3—C41.455 (4)C25—H250.93
C4—C51.386 (4)C26—C271.377 (4)
C4—C91.387 (4)C26—H260.93
C5—C61.398 (5)C27—H270.93
C5—H50.93C28—C331.363 (4)
C6—C71.355 (6)C28—C291.368 (4)
C6—H6A0.93C28—H280.93
C7—C81.353 (6)C29—C301.393 (4)
C7—H7A0.93C29—H290.93
C8—C91.384 (4)C30—C311.392 (3)
C8—H80.93C30—H300.93
C9—H90.93C31—C321.382 (4)
C10—C111.349 (4)C31—C341.462 (4)
C10—N51.363 (4)C32—C331.375 (4)
C10—H100.93C32—H320.93
C11—N61.346 (4)C33—H330.93
C11—H110.93C34—N41.337 (3)
C12—N51.326 (4)C34—N31.339 (3)
C12—N61.359 (3)C35—C361.347 (4)
C12—C131.451 (4)C35—N31.355 (3)
C13—C141.386 (4)C35—H350.93
C13—C181.395 (4)C36—N41.369 (4)
C14—C151.368 (5)C36—H360.93
C14—H140.93O1—N91.238 (3)
C15—C161.365 (5)O2—N91.241 (3)
C15—H150.93O3—N91.214 (3)
C16—C171.374 (5)O4—N101.220 (3)
C16—H160.93O5—N101.254 (3)
C17—C181.376 (4)O6—N101.241 (3)
C17—H170.93Ag1—N4i2.095 (2)
C18—H180.93Ag1—N42.095 (2)
C19—C201.359 (4)Ag2—N12.104 (2)
C19—N11.362 (4)Ag2—N52.106 (2)
C19—H190.93Ag3—N8ii2.090 (2)
C20—N21.346 (4)Ag3—N82.090 (2)
C20—H200.93N2—H20.86
C21—N11.328 (4)N3—H30.86
C21—N21.356 (3)N6—H60.86
C21—C221.455 (4)N7—H70.86
C2—C1—N8109.9 (3)C23—C24—H24120.0
C2—C1—H1125.1C24—C25—C26120.0 (4)
N8—C1—H1125.1C24—C25—H25120.0
C1—C2—N7105.6 (3)C26—C25—H25120.0
C1—C2—H2A127.2C25—C26—C27120.5 (4)
N7—C2—H2A127.2C25—C26—H26119.8
N8—C3—N7109.0 (2)C27—C26—H26119.8
N8—C3—C4127.6 (3)C26—C27—C22120.6 (3)
N7—C3—C4123.4 (2)C26—C27—H27119.7
C5—C4—C9118.6 (3)C22—C27—H27119.7
C5—C4—C3121.5 (3)C33—C28—C29120.7 (3)
C9—C4—C3119.9 (3)C33—C28—H28119.6
C4—C5—C6119.4 (4)C29—C28—H28119.6
C4—C5—H5120.3C28—C29—C30120.0 (3)
C6—C5—H5120.3C28—C29—H29120.0
C7—C6—C5120.7 (4)C30—C29—H29120.0
C7—C6—H6A119.7C31—C30—C29119.8 (3)
C5—C6—H6A119.7C31—C30—H30120.1
C8—C7—C6120.6 (4)C29—C30—H30120.1
C8—C7—H7A119.7C32—C31—C30118.3 (3)
C6—C7—H7A119.7C32—C31—C34121.7 (2)
C7—C8—C9120.1 (4)C30—C31—C34120.0 (2)
C7—C8—H8120.0C33—C32—C31121.6 (3)
C9—C8—H8120.0C33—C32—H32119.2
C8—C9—C4120.7 (3)C31—C32—H32119.2
C8—C9—H9119.7C28—C33—C32119.5 (3)
C4—C9—H9119.7C28—C33—H33120.2
C11—C10—N5109.6 (3)C32—C33—H33120.2
C11—C10—H10125.2N4—C34—N3109.0 (2)
N5—C10—H10125.2N4—C34—C31127.2 (2)
N6—C11—C10106.1 (3)N3—C34—C31123.8 (2)
N6—C11—H11127.0C36—C35—N3106.1 (2)
C10—C11—H11127.0C36—C35—H35126.9
N5—C12—N6108.5 (3)N3—C35—H35126.9
N5—C12—C13127.8 (3)C35—C36—N4109.4 (2)
N6—C12—C13123.7 (3)C35—C36—H36125.3
C14—C13—C18118.3 (3)N4—C36—H36125.3
C14—C13—C12121.2 (3)N4i—Ag1—N4180
C18—C13—C12120.5 (3)N1—Ag2—N5175.94 (11)
C15—C14—C13120.5 (3)N8ii—Ag3—N8180
C15—C14—H14119.8C21—N1—C19106.7 (2)
C13—C14—H14119.8C21—N1—Ag2128.9 (2)
C16—C15—C14121.0 (3)C19—N1—Ag2124.3 (2)
C16—C15—H15119.5C20—N2—C21108.8 (3)
C14—C15—H15119.5C20—N2—H2125.6
C15—C16—C17119.6 (4)C21—N2—H2125.6
C15—C16—H16120.2C34—N3—C35109.1 (2)
C17—C16—H16120.2C34—N3—H3125.4
C16—C17—C18120.2 (3)C35—N3—H3125.4
C16—C17—H17119.9C34—N4—C36106.4 (2)
C18—C17—H17119.9C34—N4—Ag1129.74 (18)
C17—C18—C13120.4 (3)C36—N4—Ag1123.83 (18)
C17—C18—H18119.8C12—N5—C10106.9 (2)
C13—C18—H18119.8C12—N5—Ag2130.1 (2)
C20—C19—N1109.5 (3)C10—N5—Ag2122.3 (2)
C20—C19—H19125.3C11—N6—C12108.9 (3)
N1—C19—H19125.3C11—N6—H6125.5
N2—C20—C19106.0 (3)C12—N6—H6125.5
N2—C20—H20127.0C3—N7—C2109.3 (2)
C19—C20—H20127.0C3—N7—H7125.4
N1—C21—N2109.0 (3)C2—N7—H7125.4
N1—C21—C22127.8 (3)C3—N8—C1106.2 (2)
N2—C21—C22123.2 (3)C3—N8—Ag3129.2 (2)
C27—C22—C23117.4 (3)C1—N8—Ag3124.61 (19)
C27—C22—C21120.9 (3)O3—N9—O1121.0 (3)
C23—C22—C21121.6 (3)O3—N9—O2121.6 (3)
C24—C23—C22121.5 (3)O1—N9—O2117.4 (3)
C24—C23—H23119.2O4—N10—O6122.3 (3)
C22—C23—H23119.2O4—N10—O5120.1 (3)
C25—C24—C23120.0 (3)O6—N10—O5117.6 (3)
C25—C24—H24120.0
D—H···AD—HH···AD···AD—H···A
N2—H2···O6i0.862.032.893 (3)178
N3—H3···O5iii0.861.952.812 (3)178
N6—H6···O2ii0.861.992.846 (3)173
N7—H7···O1iv0.861.952.812 (3)177
Table 1

Hydrogen-bond geometry (Å, °)

D—H⋯AD—HH⋯ADAD—H⋯A
N2—H2⋯O6i0.862.032.893 (3)178
N3—H3⋯O5ii0.861.952.812 (3)178
N6—H6⋯O2iii0.861.992.846 (3)173
N7—H7⋯O1iv0.861.952.812 (3)177

Symmetry codes: (i) ; (ii) ; (iii) ; (iv) .

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1.  A short history of SHELX.

Authors:  George M Sheldrick
Journal:  Acta Crystallogr A       Date:  2007-12-21       Impact factor: 2.290

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Authors:  Jin Yang; Jian-Fang Ma; Stuart R Batten; Zhong-Min Su
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1.  2-Phenyl-imidazolium chloride monohydrate.

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