Newly refined data for 6,6',8,8'-tetraphenyl-3,3',4,4'-tetrahydro-1H,1'H-2,2'-spirobi[quinoline] AB1622
DOI: 10.14469/hpc/15039 Metadata
Created: 2025-03-12 16:17
Last modified: 2025-03-13 08:57
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Refined using NOSPHERAT2
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| AB1622 QM.cif | 708KB | chemical/x-cif | CIF Data |
| AB1622 QM checkCIF.pdf | 162KB | application/pdf | CheckCIF REport |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/15030 | Crystallography meets DFT Quantum modelling |
Associated DOIs
| Current dataset ... | DOI | Description |
|---|---|---|
| References | 10.14469/hpc/2303 | Original dats |
Subject Keywords
| Keyword | Value |
|---|---|
| inchi | InChI=1S/C35H27N2.C6H4.3H/c1-4-11-25(12-5-1)30-23-29-20-22-35(37-34(29)32(24-30)27-15-8-3-9-16-27)21-19-28-17-10-18-31(33(28)36-35)26-13-6-2-7-14-26;1-2-4-6-5-3-1;;;/h1-9,11-13,15-18,20,23-24,36-37H,19,21-22H2;1-4H;;;/t35-;;;;/m0..../s1 |
| inchikey | YUVFXCDURSILNP-HPZBLMNFSA-N |