{3,3',3'',3'''-[(7S,8S,12S,13S)-8,13-Bis(Carboxymethyl)-3,8,13,17-Tetramethyl-7,8,12,13-Tetrahydroporphyrin-2,7,12,18-Tetrayl-Kappa~4~N~21~,N~22~,N~23~,N~24~]Tetrapropanoato(2-)}Iron

Molecule SVG Image

Properties Simple | Detailed

Formula C40H44FeN4O12
IUPAC Name {3,3',3'',3'''-[(7s,8s,12s,13s)-8,13-bis(carboxymethyl)-3,8,13,17-tetramethyl-7,8,12,13-tetrahydroporphyrin-2,7,12,18-tetrayl-kappa 4 n 21 ,n 22 ,n 23 ,n 24 ]tetrapropanoato(2-)}iron
Molecular Mass 828.642 g·mol−1
Heat of Formation 2325.3 ± 16.7 kJ·mol−1
Dipole Moment 4.56 ± 1.08 D
Volume 801.63 Å 3
Surface Area 623.01 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
InChIKey JJIIPBCQUZPJAW-XOLYYWOLSA-L
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Fe O N