3-(Carboxymethyl)-12-Ethyl-8,13,17-Trimethyl- 21H,23H-Porphine-2,7,18-Tripropanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C36H38N4O8
IUPAC Name 3-[(15z,19z)-13,18-bis(2-carboxyethyl)-17-(carboxymethyl)-8-ethyl-3,7,12-trimethyl-porphyrin-21,22,23-triium-9-ylium-2-yl]propanoic acid
Molecular Mass 654.709 g·mol−1
Heat of Formation -1119.4 ± 16.7 kJ·mol−1
Dipole Moment 12.79 ± 1.08 D
Volume 777.26 Å 3
Surface Area 618.92 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy -1.93 ± eV
Point Group Symmetry C1
InChIKey UHKZSWAPQUEURH-TXUIXYGZSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N