(17S,18S)-18-{3-[(2-Aminoethyl)Amino]-3-Oxopropyl}-20-(Carboxymethyl)-7-Ethyl-3,8,13,17-Tetramethyl-12-Vinyl-17,18-Dihydro-2-Porphyrincarboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C36H45N6O5
IUPAC Name (9z)-18-[3-(2-aminoethylamino)-3-oxo-propyl]-20-(carboxymethyl)-7-ethyl-3,8,13,17-tetramethyl-12-vinyl-17,18-dihydroporphyrin-21,23,24-triium-8,12-diide-2-carboxylic acid
Molecular Mass 641.780 g·mol−1
Heat of Formation -428.0 ± 16.7 kJ·mol−1
Dipole Moment 8.19 ± 1.08 D
Volume 774.1 Å 3
Surface Area 616.1 Å 2
HOMO Energy -7.85 ± 0.55 eV
LUMO Energy -1.76 ± eV
Point Group Symmetry C1
InChIKey KCDJYFWSPASCQO-GESAQZPFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N