| Formula |
C18H18ClN3O |
| IUPAC Name |
(2r,3s)-3-(4-aza-1-azonia-2-azanidacyclopenta-3,5-dien-1-yl)-4-(4-chlorophenyl)-2-phenyl-butan-2-ol |
| Molecular Mass |
327.808 g·mol−1 |
| Heat of Formation |
117.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.35 ± 1.08 D |
| Volume |
393.9 Å 3 |
| Surface Area |
325.21 Å 2 |
| HOMO Energy |
-9.66 ± 0.55 eV |
| LUMO Energy |
-0.36 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
YULDTPKHZNKFEY-ZWKOTPCHSA-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
N
O
Cl
|
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