Crystallography Open Database

Information card for entry 7051339

Preview

Coordinates	7051339.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H24 Br4 N4 O
Calculated formula	C6 H23 Br4 N4 O
SMILES	[Br-].[Br-].[Br-].[Br-].[Br-].[OH3+].[NH3+]CC[NH2+]CC[NH2+]CC[NH3+]
Journal of publication	New Journal of Chemistry
Year of publication	2000
Journal volume	24
Journal issue	10
Pages of publication	787 - 798
a	14.286 ± 0.003 Å
b	16.187 ± 0.003 Å
c	14.162 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3274.9 ± 1.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	41
Hermann-Mauguin space group symbol	A b a 2
Hall space group symbol	A 2 -2ab
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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