Information card for entry 2002928

Structure parameters

• Formula: C12 H12
• Calculated formula: C12 H12
• SMILES: Cc1ccc2c(c1)ccc(c2)C
• Title of publication: Structures of 2,6-disubstituted naphthalenes
• Authors of publication: Kaduk, J.A.; Golab, J.T.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 1
• Pages of publication: 85 - 94
• a: 7.4544 ± 0.0004 Å
• b: 6.0826 ± 0.0006 Å
• c: 20.0946 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 911.13 ± 0.12 ų
• Number of distinct elements: 2
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No