N-[(5α,6Beta)-17-(Cyclopropylmethyl)-3,14-Dihydroxy-4,5-Epoxymorphinan-6-Yl]-N~2~-Methyl-N~2~-(7-Nitro-2,1,3-Benzoxadiazol-4-Yl)Glycinamide
Properties
Property | Value |
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Formula | C29H32N6O7 |
IUPAC Name | n-[(4r,4as,7r,7ar,12bs)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]-2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]acetamide |
Molecular Mass | 576.600 g·mol−1 |
Heat of Formation | -238.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.71 ± 1.08 D |
Volume | 651.35 Å 3 |
Surface Area | 469.54 Å 2 |
HOMO Energy | -8.74 ± 0.55 eV |
LUMO Energy | -2.06 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | IOLXIFPZKUBGMJ-LOSGQLGCSA-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 |