(Z)-N1-Methyl-N1'-[2-[[2-(Methylaminomethyl)-5H-Thiazol-3-Ium-5-Id-4-Yl]Methylsulfanyl]Ethyl]-2-Nitro-Ethene-1,1-Diamine

Molecule SVG Image

Properties Simple | Detailed

Formula C11H20N5O2S2
IUPAC Name (z)-n1-methyl-n1'-[2-[[2-(methylaminomethyl)-5h-thiazol-3-ium-5-id-4-yl]methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine
Molecular Mass 318.439 g·mol−1
Heat of Formation 101.9 ± 16.7 kJ·mol−1
Dipole Moment 11.28 ± 1.08 D
Volume 375.02 Å 3
Surface Area 320.7 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
InChIKey BNGJKPNCTSRHSF-POHAHGRESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N