N,N-Dimethyl-4-(4-Phenyl-1H-Pyrazol-3-Yl)-1H-Pyrrole-2-Carboxamide
Properties
Property | Value |
---|---|
Formula | C16H16N4O |
IUPAC Name | n,n-dimethyl-4-(4-phenylpyrazol-1-ium-2-id-3-yl)pyrrole-2-carboxamide |
Molecular Mass | 280.324 g·mol−1 |
Heat of Formation | 214.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.64 ± 1.08 D |
Volume | 338.3 Å 3 |
Surface Area | 303.12 Å 2 |
HOMO Energy | -8.69 ± 0.55 eV |
LUMO Energy | -0.35 ± eV |
Point Group Symmetry | C1 |
InChIKey | OPBUUQBZKJSWTN-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |