Formula |
C20H22N4O2 |
IUPAC Name |
(2s)-2-amino-n-(1,5-dimethyl-3-oxo-2-phenyl-pyrazole-1,2-diium-4-yl)-3-phenyl-propanamide |
Molecular Mass |
350.414 g·mol−1 |
Heat of Formation |
-5.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.92 ± 1.08 D |
Volume |
425.35 Å 3 |
Surface Area |
359.3 Å 2 |
HOMO Energy |
-8.62 ± 0.55 eV |
LUMO Energy |
-0.31 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-2-amino-n-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-phenylpropanamide
- (2s)-2-amino-n-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-phenyl-propanamide
- (2s)-2-amino-n-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-phenylpropanamide
- (2s)-2-amino-n-(3-keto-1,5-dimethyl-2-phenyl-pyrazol-4-yl)-3-phenyl-propionamide
|
InChIKey |
WTJPUXLQJJVGOF-KRWDZBQOSA-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
|
|
|