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-[(1z,9z,14z)-13,17-bis(2-carboxylatoethyl)-18-(carboxylatomethyl)-7-ethyl-3,8,12-tri(methyl)porphyrin-16-ylium-22-id-2-yl]propanoate
Molecular Mass 654.709 g·mol−1
Heat of Formation 2743.9 ± 16.7 kJ·mol−1
Dipole Moment 5.78 ± 1.08 D
Volume 666.86 Å 3
Surface Area 537.48 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -2.17 ± eV
Point Group Symmetry C1
InChIKey UHKZSWAPQUEURH-OZODTHNESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N