| Formula |
C20H21FN2O |
| IUPAC Name |
(1s)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3h-isobenzofuran-5-carbonitrile |
| Molecular Mass |
324.392 g·mol−1 |
| Heat of Formation |
-66.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.68 ± 1.08 D |
| Volume |
403.25 Å 3 |
| Surface Area |
357.41 Å 2 |
| HOMO Energy |
-8.87 ± 0.55 eV |
| LUMO Energy |
-1.04 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (1s)-1-(3-dimethylaminopropyl)-1-(4-fluorophenyl)-3h-2-benzofuran-5-carbonitrile
- (1s)-1-(3-dimethylaminopropyl)-1-(4-fluorophenyl)-3h-isobenzofuran-5-carbonitrile
- (1s)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile
- (s)-citalopram
- 5-isobenzofurancarbonitrile, 1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydro-, (1s)-
- s(+)-citalopram
- tocris-1427
|
| CAS Number(s) |
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| InChIKey |
WSEQXVZVJXJVFP-FQEVSTJZSA-N |
| QR Code |
Generate QR Code |
| Links |
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
N
O
F
|
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