catena-Poly[[silver(I)-μ-N-(3-pyridyl-meth-yl)pyridine-4-carboxamide] nitrate monohydrate].

In the title compound, {[Ag(C(12)H(11)N(3)O)]NO(3)·H(2)O}(n), the Ag atom is coordinated by two N atoms from the heterocyclic ligand, giving a linear polycationic chain. Two long Ag⋯O(nitrate) inter-actions [2.667 (3) and 2.840 (3) Å] result in a three-dimensional network. The water mol-ecule consolidates the network structure by forming hydrogen bonds, one to the polycationic chain and one to the nitrate anion.

Related literature

For related literature, see: Cordes & Hanton (2007 ▶); Kumar et al. (2006 ▶); Tong et al. (2002 ▶).

Experimental

Crystal data

[Ag(C12H11N3O)]NO3·H2O

M = 401.13

Monoclinic,

a = 12.177 (2) Å

b = 13.022 (3) Å

c = 8.9109 (18) Å

β = 94.21 (3)°

V = 1409.2 (5) Å3

Z = 4

Mo Kα radiation

μ = 1.46 mm−1

T = 293 (2) K

0.6 × 0.4 × 0.2 mm

Data collection

Rigaku Mercury CCD diffractometer

Absorption correction: multi-scan (CrystalClear; Rigaku/MSC, 2003 ▶) T min = 0.503, T max = 0.742

14304 measured reflections

3230 independent reflections

2399 reflections with I > 2σ(I)

R int = 0.065

Refinement

R[F 2 > 2σ(F 2)] = 0.042

wR(F 2) = 0.101

S = 1.06

3230 reflections

199 parameters

H-atom parameters constrained

Δρmax = 0.35 e Å−3

Δρmin = −0.43 e Å−3

Data collection: CrystalClear (Rigaku/MSC, 2003 ▶); cell refinement: CrystalClear; data reduction: CrystalClear; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997 ▶); molecular graphics: SHELXTL (Sheldrick, 1999 ▶); software used to prepare material for publication: SHELXTL.

Crystal structure: contains datablocks I, global. DOI: 10.1107/S1600536807064744/pk2069sup1.cif

Structure factors: contains datablocks I. DOI: 10.1107/S1600536807064744/pk2069Isup2.hkl

Additional supplementary materials: crystallographic information; 3D view; checkCIF report

[Ag(C12H11N3O)]NO3·H2O	F000 = 800
Mr = 401.13	Dx = 1.891 Mg m−3
Monoclinic, P21/c	Mo Kα radiation λ = 0.71073 Å
Hall symbol: -P 2ybc	Cell parameters from 5866 reflections
a = 12.177 (2) Å	θ = 3.2–27.5º
b = 13.022 (3) Å	µ = 1.46 mm−1
c = 8.9109 (18) Å	T = 293 (2) K
β = 94.21 (3)º	Block, colorless
V = 1409.2 (5) Å3	0.6 × 0.4 × 0.2 mm
Z = 4

Rigaku Mercury CCD diffractometer	3230 independent reflections
Radiation source: fine-focus sealed tube	2399 reflections with I > 2σ(I)
Monochromator: graphite	Rint = 0.065
T = 293(2) K	θmax = 27.5º
ω scans	θmin = 3.1º
Absorption correction: multi-scan(CrystalClear; Rigaku/MSC, 2003)	h = −15→15
Tmin = 0.503, Tmax = 0.742	k = −16→16
14304 measured reflections	l = −11→11

Refinement on F2	Secondary atom site location: difference Fourier map
Least-squares matrix: full	Hydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.042	H-atom parameters constrained
wR(F2) = 0.101	w = 1/[σ2(Fo2) + (0.0433P)2 + 0.2355P] where P = (Fo2 + 2Fc2)/3
S = 1.06	(Δ/σ)max < 0.001
3230 reflections	Δρmax = 0.35 e Å−3
199 parameters	Δρmin = −0.43 e Å−3
Primary atom site location: structure-invariant direct methods	Extinction correction: none

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 > 2σ(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.

	x	y	z	Uiso*/Ueq
Ag1	−0.01568 (2)	0.32484 (2)	0.11987 (4)	0.04917 (14)
N3	0.1306 (2)	0.3030 (2)	0.0011 (3)	0.0377 (7)
C9	0.1867 (3)	0.3832 (3)	−0.0444 (4)	0.0453 (9)
H9A	0.1644	0.4486	−0.0176	0.054*
C7	0.2524 (3)	0.1954 (3)	−0.1219 (4)	0.0426 (9)
H7A	0.2731	0.1291	−0.1467	0.051*
C8	0.1637 (3)	0.2107 (3)	−0.0387 (4)	0.0448 (9)
H8A	0.1249	0.1537	−0.0087	0.054*
C11	0.3109 (3)	0.2785 (3)	−0.1690 (4)	0.0321 (7)
C10	0.2755 (3)	0.3746 (3)	−0.1283 (4)	0.0418 (9)
H10A	0.3120	0.4331	−0.1580	0.050*
C12	0.4107 (3)	0.2716 (3)	−0.2571 (4)	0.0348 (8)
N4	0.4370 (2)	0.1789 (2)	−0.3061 (3)	0.0396 (7)
H4A	0.3962	0.1273	−0.2872	0.047*
C13	0.5327 (3)	0.1630 (3)	−0.3904 (4)	0.0444 (9)
H13A	0.5431	0.2231	−0.4520	0.053*
H13B	0.5188	0.1051	−0.4576	0.053*
C4	0.6375 (3)	0.1431 (3)	−0.2938 (4)	0.0335 (8)
C5	0.7368 (3)	0.1578 (3)	−0.3533 (4)	0.0358 (8)
H5A	0.7365	0.1849	−0.4499	0.043*
N1	0.8337 (2)	0.1358 (2)	−0.2817 (3)	0.0387 (7)
C1	0.8340 (3)	0.0972 (3)	−0.1428 (4)	0.0472 (9)
H1B	0.9007	0.0798	−0.0917	0.057*
C2	0.7385 (3)	0.0825 (3)	−0.0737 (4)	0.0485 (10)
H2A	0.7410	0.0577	0.0243	0.058*
C3	0.6391 (3)	0.1044 (3)	−0.1492 (4)	0.0413 (9)
H3A	0.5738	0.0933	−0.1038	0.050*
O1	0.4653 (2)	0.3480 (2)	−0.2803 (3)	0.0550 (8)
O2	−0.0055 (2)	0.1263 (3)	0.1929 (4)	0.0669 (8)
N2	−0.0802 (3)	0.0813 (3)	0.2490 (3)	0.0427 (7)
O3	−0.1439 (3)	0.1264 (3)	0.3279 (4)	0.0735 (9)
O1W	0.6452 (2)	0.4755 (2)	−0.2057 (4)	0.0624 (8)
H1WA	0.5932	0.4332	−0.2267	0.075*
H1WB	0.7033	0.4393	−0.1928	0.075*
O4	−0.0959 (3)	−0.0117 (2)	0.2228 (4)	0.0702 (9)

	U11	U22	U33	U12	U13	U23
Ag1	0.03123 (18)	0.0563 (2)	0.0621 (2)	0.00455 (13)	0.01775 (14)	−0.00438 (15)
N3	0.0300 (16)	0.0400 (18)	0.0435 (18)	0.0011 (13)	0.0066 (13)	−0.0052 (13)
C9	0.042 (2)	0.034 (2)	0.061 (3)	0.0054 (17)	0.0109 (19)	−0.0029 (18)
C7	0.041 (2)	0.033 (2)	0.057 (2)	−0.0023 (16)	0.0209 (18)	−0.0077 (16)
C8	0.039 (2)	0.043 (2)	0.055 (2)	−0.0071 (17)	0.0197 (18)	−0.0027 (18)
C11	0.0277 (17)	0.0366 (19)	0.0319 (18)	0.0012 (15)	0.0013 (14)	0.0008 (14)
C10	0.039 (2)	0.035 (2)	0.053 (2)	−0.0021 (17)	0.0105 (17)	0.0004 (17)
C12	0.0267 (18)	0.042 (2)	0.0363 (19)	−0.0045 (16)	0.0048 (14)	−0.0007 (16)
N4	0.0270 (15)	0.0483 (19)	0.0448 (18)	−0.0020 (13)	0.0127 (13)	−0.0045 (14)
C13	0.032 (2)	0.062 (3)	0.041 (2)	0.0028 (18)	0.0105 (16)	−0.0027 (17)
C4	0.0324 (19)	0.0360 (18)	0.0324 (18)	0.0020 (15)	0.0060 (15)	−0.0046 (14)
C5	0.0305 (18)	0.041 (2)	0.0373 (19)	0.0019 (15)	0.0103 (15)	0.0014 (15)
N1	0.0285 (16)	0.0443 (17)	0.0447 (18)	−0.0018 (14)	0.0108 (13)	0.0025 (14)
C1	0.036 (2)	0.056 (3)	0.050 (2)	0.0012 (18)	0.0028 (17)	0.0017 (19)
C2	0.045 (2)	0.066 (3)	0.036 (2)	0.002 (2)	0.0075 (17)	0.0058 (18)
C3	0.037 (2)	0.048 (2)	0.041 (2)	−0.0032 (17)	0.0150 (16)	−0.0004 (17)
O1	0.0404 (16)	0.0537 (17)	0.073 (2)	−0.0142 (13)	0.0212 (14)	−0.0028 (14)
O2	0.055 (2)	0.068 (2)	0.080 (2)	−0.0126 (16)	0.0235 (16)	0.0100 (18)
N2	0.0371 (18)	0.050 (2)	0.0413 (18)	−0.0045 (15)	0.0028 (14)	0.0039 (15)
O3	0.066 (2)	0.076 (2)	0.082 (2)	−0.0028 (18)	0.0310 (18)	−0.0178 (18)
O1W	0.0471 (17)	0.0461 (17)	0.094 (2)	−0.0057 (14)	0.0067 (15)	−0.0046 (15)
O4	0.068 (2)	0.0443 (18)	0.098 (3)	−0.0020 (16)	0.0053 (18)	0.0006 (16)

Ag1—N1i	2.152 (3)	C13—H13A	0.9700
Ag1—N3	2.157 (3)	C13—H13B	0.9700
N3—C8	1.324 (5)	C4—C5	1.369 (5)
N3—C9	1.328 (5)	C4—C3	1.382 (5)
C9—C10	1.363 (5)	C5—N1	1.331 (4)
C9—H9A	0.9300	C5—H5A	0.9300
C7—C8	1.369 (5)	N1—C1	1.336 (5)
C7—C11	1.378 (5)	N1—Ag1ii	2.152 (3)
C7—H7A	0.9300	C1—C2	1.368 (5)
C8—H8A	0.9300	C1—H1B	0.9300
C11—C10	1.381 (5)	C2—C3	1.370 (5)
C11—C12	1.497 (5)	C2—H2A	0.9300
C10—H10A	0.9300	C3—H3A	0.9300
C12—O1	1.222 (4)	O2—N2	1.220 (4)
C12—N4	1.331 (4)	N2—O3	1.234 (4)
N4—C13	1.447 (5)	N2—O4	1.245 (4)
N4—H4A	0.8600	O1W—H1WA	0.8499
C13—C4	1.508 (5)	O1W—H1WB	0.8500
N1i—Ag1—N3	172.19 (11)	C4—C13—H13A	108.7
C8—N3—C9	117.3 (3)	N4—C13—H13B	108.7
C8—N3—Ag1	122.0 (2)	C4—C13—H13B	108.7
C9—N3—Ag1	120.5 (2)	H13A—C13—H13B	107.6
N3—C9—C10	123.3 (3)	C5—C4—C3	117.3 (3)
N3—C9—H9A	118.3	C5—C4—C13	119.3 (3)
C10—C9—H9A	118.3	C3—C4—C13	123.3 (3)
C8—C7—C11	119.8 (3)	N1—C5—C4	124.2 (3)
C8—C7—H7A	120.1	N1—C5—H5A	117.9
C11—C7—H7A	120.1	C4—C5—H5A	117.9
N3—C8—C7	123.0 (3)	C5—N1—C1	117.8 (3)
N3—C8—H8A	118.5	C5—N1—Ag1ii	120.4 (2)
C7—C8—H8A	118.5	C1—N1—Ag1ii	121.6 (2)
C7—C11—C10	117.0 (3)	N1—C1—C2	121.7 (4)
C7—C11—C12	124.8 (3)	N1—C1—H1B	119.2
C10—C11—C12	118.3 (3)	C2—C1—H1B	119.2
C9—C10—C11	119.6 (4)	C1—C2—C3	120.0 (4)
C9—C10—H10A	120.2	C1—C2—H2A	120.0
C11—C10—H10A	120.2	C3—C2—H2A	120.0
O1—C12—N4	122.4 (3)	C2—C3—C4	119.0 (3)
O1—C12—C11	120.8 (3)	C2—C3—H3A	120.5
N4—C12—C11	116.8 (3)	C4—C3—H3A	120.5
C12—N4—C13	121.5 (3)	O2—N2—O3	121.6 (4)
C12—N4—H4A	119.2	O2—N2—O4	119.9 (4)
C13—N4—H4A	119.2	O3—N2—O4	118.4 (3)
N4—C13—C4	114.1 (3)	H1WA—O1W—H1WB	105.6
N4—C13—H13A	108.7
C8—N3—C9—C10	−0.2 (6)	C11—C12—N4—C13	−179.1 (3)
Ag1—N3—C9—C10	−175.6 (3)	C12—N4—C13—C4	87.7 (4)
C9—N3—C8—C7	0.6 (6)	N4—C13—C4—C5	−160.2 (3)
Ag1—N3—C8—C7	175.9 (3)	N4—C13—C4—C3	23.9 (5)
C11—C7—C8—N3	−0.5 (7)	C3—C4—C5—N1	1.0 (5)
C8—C7—C11—C10	−0.1 (6)	C13—C4—C5—N1	−175.1 (3)
C8—C7—C11—C12	178.4 (4)	C4—C5—N1—C1	−0.2 (5)
N3—C9—C10—C11	−0.3 (6)	C4—C5—N1—Ag1ii	−174.5 (3)
C7—C11—C10—C9	0.4 (6)	C5—N1—C1—C2	−1.5 (6)
C12—C11—C10—C9	−178.1 (3)	Ag1ii—N1—C1—C2	172.8 (3)
C7—C11—C12—O1	−171.7 (4)	N1—C1—C2—C3	2.2 (6)
C10—C11—C12—O1	6.7 (5)	C1—C2—C3—C4	−1.3 (6)
C7—C11—C12—N4	7.3 (6)	C5—C4—C3—C2	−0.3 (5)
C10—C11—C12—N4	−174.2 (3)	C13—C4—C3—C2	175.7 (4)
O1—C12—N4—C13	0.0 (6)

D—H···A	D—H	H···A	D···A	D—H···A
N4—H4A···O1Wiii	0.86	2.04	2.837 (4)	154
O1W—H1WA···O1	0.85	1.94	2.790 (4)	174
O1W—H1WB···O3ii	0.85	2.04	2.886 (4)	171

Table 1

Hydrogen-bond geometry (Å, °)

D—H⋯A	D—H	H⋯A	D⋯A	D—H⋯A
N4—H4A⋯O1Wi	0.86	2.04	2.837 (4)	154
O1W—H1WA⋯O1	0.85	1.94	2.790 (4)	174
O1W—H1WB⋯O3ii	0.85	2.04	2.886 (4)	171

Symmetry codes: (i) ; (ii) .