Crystallography Open Database

Information card for entry 2214291

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Structure parameters

Chemical name	[Bis(1<i>H</i>-benzimidazol-2-ylmethyl)amine-κ^3^N,N',N'']dinitratolead(II)
Formula	C16 H15 N7 O6 Pb
Calculated formula	C16 H15 N7 O6 Pb
SMILES	[Pb]12([NH](Cc3[n]1c1c(cccc1)[nH]3)Cc1[n]2c2c(cccc2)[nH]1)(ON(=O)=O)ON(=O)=O
Title of publication	[Bis(1<i>H</i>-benzimidazol-2-ylmethyl)amine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']dinitratolead(II)
Authors of publication	Zhang, Yong; Xia, Xian-You; Liu, Xu-Qing; Chen, Xue-Mei; Liu, Ting
Journal of publication	Acta Crystallographica Section E
Year of publication	2007
Journal volume	63
Journal issue	7
Pages of publication	m1792 - m1792
a	8.9865 ± 0.0004 Å
b	10.4501 ± 0.0005 Å
c	11.3544 ± 0.0005 Å
α	98.296 ± 0.001°
β	102.842 ± 0.001°
γ	104.642 ± 0.001°
Cell volume	982.88 ± 0.08 Å³
Cell temperature	292 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0483
Residual factor for significantly intense reflections	0.0448
Weighted residual factors for significantly intense reflections	0.1195
Weighted residual factors for all reflections included in the refinement	0.1263
Goodness-of-fit parameter for all reflections included in the refinement	1.122
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	Mokα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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