2-Amino-7-(2-Chloroethyl)-3H-Purine-1,9-Diium-5-Id-6-One

Molecule SVG Image

Properties Simple | Detailed

Formula C7H9ClN5O
IUPAC Name 2-amino-7-(2-chloroethyl)-3h-purine-1,9-diium-5-id-6-one
Molecular Mass 214.632 g·mol−1
Heat of Formation 41.2 ± 16.7 kJ·mol−1
Dipole Moment 4.90 ± 1.08 D
Volume 226.31 Å 3
Surface Area 215.99 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey YUYZWSXMOHOWHV-UHFFFAOYSA-O
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl