2-(Trifluoromethyl)-L-Histidyl-N-{[(2S)-5-Oxo-2-Pyrrolidinyl]Carbonyl}-L-Prolinamide

Molecule SVG Image

Properties Simple | Detailed

Formula C17H21F3N6O4
IUPAC Name (2s)-n-[(2s)-1-[(2r)-2-amino-3-[2-(trifluoromethyl)imidazol-3-ium-4-ylium-4-yl]propanoyl]pyrrolidine-2-carbonyl]-5-oxo-pyrrolidine-2-carboxamide
Molecular Mass 430.382 g·mol−1
Heat of Formation -1260.9 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 475.1 Å 3
Surface Area 384.14 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy 2.46 ± eV
Point Group Symmetry C1
InChIKey VFWHEXLJERBSPY-VWYCJHECSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F