| Formula |
C22H20FN3OS |
| IUPAC Name |
n-[[(2s)-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]thiophene-3-carboxamide |
| Molecular Mass |
393.477 g·mol−1 |
| Heat of Formation |
72.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.84 ± 1.08 D |
| Volume |
456.78 Å 3 |
| Surface Area |
365.75 Å 2 |
| HOMO Energy |
-8.39 ± 0.55 eV |
| LUMO Energy |
-0.74 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
NPGABYHTDVGGJK-MRXNPFEDSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
| |
|
