N-[(2-Chloroethyl)(Nitroso)Carbamoyl]-2,3-O-Isopropylidene-5-O-(4-Nitrobenzoyl)-β-D-Ribofuranosylamine

Molecule SVG Image

Properties Simple | Detailed

Formula C18H21ClN4O9
IUPAC Name [(3ar,4r,6r,6ar)-4-[[2-chloroethyl(nitroso)carbamoyl]amino]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-nitrobenzoate
Molecular Mass 472.834 g·mol−1
Heat of Formation -1094.5 ± 16.7 kJ·mol−1
Dipole Moment 3.64 ± 1.08 D
Volume 497.9 Å 3
Surface Area 376.95 Å 2
HOMO Energy -10.32 ± 0.55 eV
LUMO Energy 1.26 ± eV
Point Group Symmetry C1
InChIKey YASNUXZKZNVXIS-KBUPBQIOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl