4-Bromo-5-Methyl-N-[1-(3-Nitro-2-Pyridinyl)-4-Piperidinyl]-1H-Pyrrole-2-Carboxamide
Properties
Property | Value |
---|---|
Formula | C16H18BrN5O3 |
IUPAC Name | 4-bromo-5-methyl-n-[1-(3-nitro-2-pyridyl)-4-piperidyl]-1h-pyrrole-2-carboxamide |
Molecular Mass | 408.250 g·mol−1 |
Heat of Formation | 49.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.37 ± 1.08 D |
Volume | 412.72 Å 3 |
Surface Area | 368.15 Å 2 |
HOMO Energy | -9.06 ± 0.55 eV |
LUMO Energy | 1.68 ± eV |
Point Group Symmetry | C1 |
InChIKey | AUXATGQLTJKTRN-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C Br O N |