| Formula |
C31H31N5O3 |
| IUPAC Name |
4-[(2s)-3-[4-[(s)-[4-(cyanomethoxy)phenyl]-phenyl-methyl]piperazin-1-yl]-2-hydroxy-propoxy]-7h-indol-1-ium-7-ide-2-carbonitrile |
| Molecular Mass |
521.610 g·mol−1 |
| Heat of Formation |
197.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.67 ± 1.08 D |
| Volume |
637.04 Å 3 |
| Surface Area |
547.98 Å 2 |
| HOMO Energy |
-8.70 ± 0.55 eV |
| LUMO Energy |
-0.81 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
OTQWYXOVIWDIFW-MXBOTTGLSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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