Information card for entry 2104551

Structure parameters

• Common name: trans-(1,4-bis((S)-4-isopropyl-4,5-dihydrooxazol-2-yl)benzene)2Cu2Cl4
• Chemical name: trans-bis(mu(2)-(1,4-bis((S)-4-isopropyl-4,5-dihydro-oxazol-2-yl)benzene))- tetrachloro-di-copper(ii)
• Formula: C36 H48 Cl4 Cu2 N4 O4
• Calculated formula: C36 H48 Cl4 Cu2 N4 O4
• SMILES: [Cu]1(Cl)(Cl)[N]2=C(c3ccc(cc3)C3=[N]([Cu](Cl)(Cl)[N]4=C(c5ccc(cc5)C5=[N]1[C@H](CO5)C(C)C)OC[C@@H]4C(C)C)[C@H](CO3)C(C)C)OC[C@@H]2C(C)C
• Title of publication: Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?
• Authors of publication: Marsh, Richard E.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: 782 - 783
• a: 13.6779 ± 0.0013 Å
• b: 10.8762 ± 0.001 Å
• c: 16.0769 ± 0.0014 Å
• α: 90°
• β: 90.024 ± 0.002°
• γ: 90°
• Cell volume: 2391.7 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No