2-[4-[[5-[[(1S)-1-(4-Nitrophenyl)Ethyl]Carbamoyl]Indol-1-Ium-1-Yl]Methyl]Phenyl]Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C31H25N3O5 |
IUPAC Name | 2-[4-[[5-[[(1s)-1-(4-nitrophenyl)ethyl]carbamoyl]indol-1-yl]methyl]phenyl]benzoic acid |
Molecular Mass | 519.547 g·mol−1 |
Heat of Formation | -122.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.22 ± 1.08 D |
Volume | 619.25 Å 3 |
Surface Area | 509.8 Å 2 |
HOMO Energy | -8.76 ± 0.55 eV |
LUMO Energy | -1.19 ± eV |
Point Group Symmetry | C1 |
InChIKey | JIHCIAJCNWUMKM-FQEVSTJZSA-N |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |