Crystallography Open Database

Information card for entry 4100351

Preview

Coordinates	4100351.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H42
Calculated formula	C56 H42
SMILES	C(=C(C(=C\c1ccccc1)/c1ccccc1)\c1ccccc1)(c1ccccc1)\C(=C(\C(=C\c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
Journal of publication	Journal of the American Chemical Society
Year of publication	2005
a	23.509 ± 0.001 Å
b	10.5602 ± 0.0006 Å
c	16.909 ± 0.002 Å
α	90°
β	99.166 ± 0.006°
γ	90°
Cell volume	4144.1 ± 0.5 Å³
Cell temperature	298.2 K
Number of distinct elements	2
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4100351.html