| Formula |
C34H30ClN5O2 |
| IUPAC Name |
1-[2-[(3s)-3-(aminomethyl)-3,4-dihydro-1h-isoquinoline-2-carbonyl]phenyl]-4-chloro-5-methyl-n,n-diphenyl-pyrazole-3-carboxamide |
| Molecular Mass |
576.087 g·mol−1 |
| Heat of Formation |
226.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.65 ± 1.08 D |
| Volume |
678.45 Å 3 |
| Surface Area |
468.21 Å 2 |
| HOMO Energy |
-8.61 ± 0.55 eV |
| LUMO Energy |
-0.87 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
MLZCQGFPFQDFLC-NDEPHWFRSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
Cl
O
N
|
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