Crystallography Open Database

Information card for entry 2100890

Preview

Coordinates	2100890.cif
Original IUCr paper	HTML

Structure parameters

Formula	C22 H20 O4
Calculated formula	C22 O4
SMILES	COC([C@@]1(C)c2ccccc2C2=C1c1ccccc1[C@]2(C)C(OC)=O)=O.COC([C@]1(C)c2ccccc2C2=C1c1ccccc1[C@@]2(C)C(OC)=O)=O
Title of publication	Crystal structure correlations in the photochemistry of dimethyl 9,10-dimethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate
Authors of publication	Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J.
Journal of publication	Acta Crystallographica Section B
Year of publication	1993
Journal volume	49
Journal issue	1
Pages of publication	107 - 116
a	21.994 ± 0.004 Å
b	11.963 ± 0.001 Å
c	19.02 ± 0.006 Å
α	90°
β	131.43 ± 0.01°
γ	90°
Cell volume	3752.1 ± 1.5 Å³
Number of distinct elements	3
Hermann-Mauguin space group symbol	C 1 2/c 1
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	Cu
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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