(2S)-3-(7-Carbamimidoyl-2-Naphthyl)-2-[4-({(3S)-1-[(1E)-Ethanimidoyl]-3-Pyrrolidinyl}Oxy)Phenyl]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C26H28N4O3 |
IUPAC Name | (2s)-3-(7-carbamimidoyl-2-naphthyl)-2-[4-[(3s)-1-ethanimidoylpyrrolidin-3-yl]oxyphenyl]propanoic acid |
Molecular Mass | 444.526 g·mol−1 |
Heat of Formation | -199.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.27 ± 1.08 D |
Volume | 543.14 Å 3 |
Surface Area | 458.63 Å 2 |
HOMO Energy | -8.99 ± 0.55 eV |
LUMO Energy | 2.20 ± eV |
Point Group Symmetry | C1 |
InChIKey | AGRCGQSFFMCBRE-DGUCVARSSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |