N-[Trans-4-(3-Amino-3-Oxopropyl)-4-Phenylcyclohexyl]-N-Cyclopropyl-4-[(2S)-1,1,1-Trifluoro-2-Hydroxy-2-Propanyl]Benzamide

Molecule SVG Image

Properties Simple | Detailed

Formula C28H33F3N2O3
IUPAC Name n-[4-(3-amino-3-oxo-propyl)-4-phenyl-cyclohexyl]-n-cyclopropyl-4-(2,2,2-trifluoro-1-hydroxy-1-methyl-ethyl)benzamide
Molecular Mass 502.568 g·mol−1
Heat of Formation -1097.8 ± 16.7 kJ·mol−1
Dipole Moment 5.07 ± 1.08 D
Volume 588.1 Å 3
Surface Area 424.32 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
InChIKey GGXWRFSOCBTDDI-YGPDHOBYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C F O N