5-[(E)-{(2S)-2-[(6-Aminohexanoyl)Amino]-2,3-Dihydro-1H-Inden-1-Ylidene}Methyl]-1,3-Benzodioxole-4-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C24H26N2O5 |
IUPAC Name | 5-[(e)-[(2s)-2-(6-aminohexanoylamino)indan-1-ylidene]methyl]-1,3-benzodioxole-4-carboxylic acid |
Molecular Mass | 422.474 g·mol−1 |
Heat of Formation | -632.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.24 ± 1.08 D |
Volume | 505.72 Å 3 |
Surface Area | 442.7 Å 2 |
HOMO Energy | -9.00 ± 0.55 eV |
LUMO Energy | 2.23 ± eV |
Point Group Symmetry | C1 |
InChIKey | FRMVVXQYUFKPPV-GQEMFKIVSA-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 |