4-({[(2S,4R)-5-Amino-4-Hydroxy-3,4-Dihydro-2H-Pyrrol-2-Yl]Carbonyl}Amino)-N-[(1E)-3,3-Diamino-2-Propen-1-Ylidene]-1H-Pyrrole-2-Carboxamide
Properties
Property | Value |
---|---|
Formula | C13H17N7O3 |
IUPAC Name | (ne)-4-[[(2s,4r)-5-amino-4-hydroxy-3,4-dihydro-2h-pyrrole-2-carbonyl]amino]-n-(3,3-diaminoprop-2-enylidene)-1h-pyrrole-2-carboxamide |
Molecular Mass | 319.319 g·mol−1 |
Heat of Formation | -194.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.13 ± 1.08 D |
Volume | 361.61 Å 3 |
Surface Area | 346.95 Å 2 |
HOMO Energy | -8.20 ± 0.55 eV |
LUMO Energy | -0.57 ± eV |
Point Group Symmetry | C1 |
InChIKey | FEZFZAMQERADMD-KEICDQSLSA-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 |