1-[(2-Amino-4-Pyridinyl)Methyl]-5-Chloro-N-({3-[(Methylsulfonyl)Amino]Phenyl}Sulfonyl)-3-(2-Oxo-1,2-Dihydro-3-Pyridinyl)-1H-Indole-2-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C27H23ClN6O6S2+
IUPAC Name 1-[(2-amino-4-pyridyl)methyl]-5-chloro-n-[3-(methanesulfonamido)phenyl]sulfonyl-3-(2-oxopyridin-1-ium-3-id-3-yl)indol-1-ium-5-ide-2-carboxamide
Molecular Mass 627.091 g·mol−1
Heat of Formation -605.8 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 673.46 Å 3
Surface Area 506.37 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
InChIKey CDTLONANIBXQJQ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N S