(4S,4Ar,5As,6S,12Ar)-7-Chloro-4-(Dimethylamino)-6,10,11,12-Tetrahydroxy-1,3-Dioxo-1,2,3,4,4A,5,5A,6,11,11A,12,12A-Dodecahydro-2-Tetracenecarboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C21H25ClN2O7
IUPAC Name (2r,4s,4ar,5ar,6r,11s,11as,12r,12as)-7-chloro-4-(dimethylamino)-6,10,11,12-tetrahydroxy-1,3-dioxo-4a,5,5a,6,11,11a,12,12a-octahydro-4h-tetracene-2-carboxamide
Molecular Mass 452.885 g·mol−1
Heat of Formation -1255.2 ± 16.7 kJ·mol−1
Dipole Moment 5.58 ± 1.08 D
Volume 485.44 Å 3
Surface Area 383.39 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy 2.47 ± eV
Point Group Symmetry C1
InChIKey DMSXRSJJYGANOR-GARDSWKVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C Cl O N