Neo-Dysidenine

Molecule SVG Image

Properties Simple | Detailed

Formula C17H23Cl6N3O2S
IUPAC Name (2s,4s)-5,5,5-trichloro-n,4-dimethyl-n-[(1r)-1-thiazol-2-ylethyl]-2-[[(3s)-4,4,4-trichloro-3-methyl-butanoyl]amino]pentanamide
Molecular Mass 546.166 g·mol−1
Heat of Formation -615.0 ± 16.7 kJ·mol−1
Dipole Moment 4.89 ± 1.08 D
Volume 576.1 Å 3
Surface Area 435.96 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4s)-5,5,5-trichloro-n,4-dimethyl-n-[(1r)-1-(1,3-thiazol-2-yl)ethyl]-2-[[(3s)-4,4,4-trichloro-3-methyl-butanoyl]amino]pentanamide
  • (2s,4s)-5,5,5-trichloro-n,4-dimethyl-n-[(1r)-1-(1,3-thiazol-2-yl)ethyl]-2-[[(3s)-4,4,4-trichloro-3-methylbutanoyl]amino]pentanamide
  • (2s,4s)-5,5,5-trichloro-n,4-dimethyl-n-[(1r)-1-(2-thiazolyl)ethyl]-2-[[(3s)-4,4,4-trichloro-3-methyl-1-oxobutyl]amino]pentanamide
  • (2s,4s)-5,5,5-trichloro-n,4-dimethyl-n-[(1r)-1-thiazol-2-ylethyl]-2-[[(3s)-4,4,4-trichloro-3-methyl-butanoyl]amino]pentanamide
  • (2s,4s)-5,5,5-trichloro-n,4-dimethyl-n-[(1r)-1-thiazol-2-ylethyl]-2-[[(3s)-4,4,4-trichloro-3-methyl-butanoyl]amino]valeramide
InChIKey MBVQTLXBQHZLRO-YFKTTZPYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N S