Crystallography Open Database

Information card for entry 4073118

Preview

Coordinates	4073118.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H16 As2 N2
Calculated formula	C16 H16 As2 N2
SMILES	[As]1(C)C=C([As](C)C=C1c1ccncc1)c1ccncc1
Title of publication	1,4-Dihydro-1,4-diarsinine: Facile Synthesis via Nonvolatile Arsenic Intermediates by Radical Reactions
Authors of publication	Nakahashi, Akiko; Naka, Kensuke; Chujo, Yoshiki
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	7
Pages of publication	1827
a	10.0732 ± 0.0016 Å
b	9.013 ± 0.002 Å
c	17.42 ± 0.003 Å
α	90°
β	100.626 ± 0.008°
γ	90°
Cell volume	1554.4 ± 0.5 Å³
Cell temperature	123.1 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for all reflections included in the refinement	0.0893
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4073118.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4073118.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4073118.cif
46170	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4073117, 4073118 via cif-deposit CGI script.	4073118.cif