Crystallography Open Database

Information card for entry 4020177

4020176 << 4020177 >> 4020178

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Coordinates	4020177.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H13 Cl2 F2 N O4
Calculated formula	C13 H13 Cl2 F2 N O4
SMILES	ClC(F)(F)[C@]1(Nc2ccc(Cl)cc2)OCOC[C@H]1C(=O)OC.ClC(F)(F)[C@@]1(Nc2ccc(Cl)cc2)OCOC[C@@H]1C(=O)OC
Authors of publication	Fu-Lu Zhao; Jin-Tao Liu
Journal of publication	Journal of Organic Chemistry
Year of publication	2005
Journal volume	70
Pages of publication	3801 - 3805
a	7.9132 ± 0.0012 Å
b	9.9342 ± 0.0016 Å
c	10.9874 ± 0.0018 Å
α	109.281 ± 0.003°
β	97.029 ± 0.003°
γ	107.275 ± 0.003°
Cell volume	754.9 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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