(2E)-3-{3-[6-(4-Methyl-1,4-Diazepan-1-Yl)-2-Pyrazinyl]Phenyl}Acrylic Acid
Properties
Property | Value |
---|---|
Formula | C19H22N4O2 |
IUPAC Name | (e)-3-[3-[6-[(4s)-4-methyl-1,4-diazepan-1-yl]pyrazin-2-yl]phenyl]prop-2-enoic acid |
Molecular Mass | 338.404 g·mol−1 |
Heat of Formation | -13.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.49 ± 1.08 D |
Volume | 410.24 Å 3 |
Surface Area | 369.12 Å 2 |
HOMO Energy | -8.79 ± 0.55 eV |
LUMO Energy | -1.05 ± eV |
Point Group Symmetry | C1 |
InChIKey | DTBFDAJNODVUMF-VOTSOKGWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |