Penipanoid A
Properties
Property | Value |
---|---|
Formula | C16H13N3O3 |
IUPAC Name | 2-[5-[(4-hydroxyphenyl)methyl]-4-aza-1-azonia-2-azanidacyclopenta-3,5-dien-1-yl]benzoic acid |
Molecular Mass | 295.293 g·mol−1 |
Heat of Formation | -142.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.04 ± 1.08 D |
Volume | 342.97 Å 3 |
Surface Area | 274.18 Å 2 |
HOMO Energy | -9.18 ± 0.55 eV |
LUMO Energy | 2.09 ± eV |
Point Group Symmetry | C1 |
InChIKey | OLKCKDFOTMJWNW-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 |