1-(4-{3-[4-(1H-Benzimidazol-2-Ylcarbonyl)Phenoxy]-2-Pyrazinyl}-1-Piperidinyl)Ethanone
Properties
Property | Value |
---|---|
Formula | C25H23N5O3 |
IUPAC Name | 1-[4-[3-[4-(benzimidazol-1-ium-2-ylium-2-carbonyl)phenoxy]pyrazin-2-yl]-1-piperidyl]ethanone |
Molecular Mass | 441.482 g·mol−1 |
Heat of Formation | -9.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.90 ± 1.08 D |
Volume | 509.15 Å 3 |
Surface Area | 449.26 Å 2 |
HOMO Energy | -9.30 ± 0.55 eV |
LUMO Energy | 1.74 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZNPDAYJZIRPRFQ-UHFFFAOYSA-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 |