2-[3-Chloro-4-(1H-Pyrrol-1-Yl)Phenyl]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C13H12ClNO2 |
IUPAC Name | (2r)-2-(3-chloro-4-pyrrol-1-yl-phenyl)propanoic acid |
Molecular Mass | 249.693 g·mol−1 |
Heat of Formation | -227.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.21 ± 1.08 D |
Volume | 278.81 Å 3 |
Surface Area | 259.18 Å 2 |
HOMO Energy | -9.07 ± 0.55 eV |
LUMO Energy | -0.85 ± eV |
Point Group Symmetry | C1 |
InChIKey | ANAQSKGWPSBAPF-SECBINFHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |