[4-[[2-Iminoethyl-[(37R)-41-(2-Iminoethylsulfanyl)-43-Methoxy-41-(Oxidomethyl)-Blahtetracyclo[Blah.Blah.Blah.Blah.Blah]Tridecan-43-Yl]Sulfonio]Methoxy]-2,4-Bis(2-Iminoethylsulfanyl)-2,4-Disulfido-1,3-Dithia-2Λ5,4Λ5-Diferracyclobut-2-Yl]Methanolate; Methanone; Oxidomethyl-(2-Sulfidoethylamino)Iron; (2-Sulfidoethylamino)Iron

Molecule SVG Image

Properties Simple | Detailed

Formula C24H61Fe8N8O8S16+
IUPAC Name [4-[[2-iminoethyl-[(37r)-41-(2-iminoethylsulfanyl)-43-methoxy-41-(oxidomethyl)-blahtetracyclo[blah.blah.blah.blah.blah]tridecan-43-yl]sulfonio]methoxy]-2,4-bis(2-iminoethylsulfanyl)-2,4-disulfido-1,3-dithia-2λ5,4λ5-diferracyclobut-2-yl]methanolate; methanone; oxidomethyl-(2-sulfidoethylamino)iron; (2-sulfidoethylamino)iron
Molecular Mass 1549.590 g·mol−1
Heat of Formation -1401.0 ± 16.7 kJ·mol−1
Dipole Moment 9.94 ± 1.08 D
Volume 1277.67 Å 3
Surface Area 783.13 Å 2
HOMO Energy -8.31 ± 0.55 eV
LUMO Energy -3.41 ± eV
Point Group Symmetry C1
InChIKey UGSWJDREOMWNTP-YJXKOYDLSA-F
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C H O N S Fe