Crystallography Open Database

Information card for entry 4061757

Preview

Coordinates	4061757.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H42 In2 N4
Calculated formula	C54 H42 In2 N4
SMILES	c1(c2ccccc2)n2[In](c3ccccc3)(c3ccccc3)[n]3c(cc(c4ccccc4)n3[In]([n]2c(c1)c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
Journal of publication	Organometallics
Year of publication	2005
a	10.226 ± 0.003 Å
b	12.212 ± 0.004 Å
c	18.225 ± 0.006 Å
α	90°
β	101.009 ± 0.009°
γ	90°
Cell volume	2234 ± 1.3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 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
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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