N-(4-{[(2S,3Ar)-2-Hydroxy-2,3,3A,4-Tetrahydropyrrolo[1,2-A]Quinoxalin-5(1H)-Yl]Carbonyl}Phenyl)-4'-Methyl-2-Biphenylcarboxamide
Properties
Property | Value |
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Formula | C32H29N3O3 |
IUPAC Name | n-[4-[(2s,3ar,10r)-2-hydroxy-2,3,3a,4-tetrahydro-1h-pyrrolo[1,2-a]quinoxaline-5-carbonyl]phenyl]-2-isopropyl-benzamide |
Molecular Mass | 503.591 g·mol−1 |
Heat of Formation | -118.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.42 ± 1.08 D |
Volume | 606.28 Å 3 |
Surface Area | 490.48 Å 2 |
HOMO Energy | -7.95 ± 0.55 eV |
LUMO Energy | 2.35 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | UACMTQPSUBFZOR-FTJBHMTQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |