N,N-Diethyl-2-[2-(3-Iodo-4-Methoxyphenyl)-5,7-Dimethylpyrazolo[1,5-A]Pyrimidin-3-Yl]Acetamide

Molecule SVG Image

Properties Simple | Detailed

Formula C21H26IN4O2+
IUPAC Name n,n-diethyl-2-[2-(3-iodo-4-methoxy-phenyl)-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-8-ium-3-yl]acetamide
Molecular Mass 493.361 g·mol−1
Heat of Formation 1.2 ± 16.7 kJ·mol−1
Dipole Moment 5.66 ± 1.08 D
Volume 496.14 Å 3
Surface Area 400.09 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy 2.46 ± eV
Point Group Symmetry C1
InChIKey TYBYEGAEDKDDES-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements I H C O N