Crystallography Open Database

Information card for entry 7234968

Preview

Coordinates	7234968.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H7 Fe N3 S2
Calculated formula	C8 H4 Fe N3 S2
Title of publication	Thermodynamically stable and metastable coordination polymers synthesized from solution and the solid state
Authors of publication	Neumann, Tristan; Gallo, Gianpiero; Jess, Inke; Dinnebier, Robert E.; Näther, Christian
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	2
Pages of publication	184 - 194
a	5.6544 ± 0.0004 Å
b	10.3052 ± 0.0008 Å
c	10.4498 ± 0.0007 Å
α	70.083 ± 0.005°
β	78.969 ± 0.007°
γ	75.518 ± 0.004°
Cell volume	550.52 ± 0.07 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
RFsqd	0.0146
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.7093 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
257461 (current)	2020-10-06	cif/ Updating files of 7234964, 7234965, 7234966, 7234967, 7234968, 7234969, 7234970 Original log message: Adding full bibliography for 7234964--7234970.cif.	7234968.cif
247673	2020-02-04	cif/ Updating files of 7234964, 7234965, 7234966, 7234967, 7234968, 7234969, 7234970 Original log message: Adding full bibliography for 7234964--7234970.cif.	7234968.cif
223273	2019-11-05	cif/ Adding structures of 7234964, 7234965, 7234966, 7234967, 7234968, 7234969, 7234970 via cif-deposit CGI script.	7234968.cif