2-{[(6-Methoxy-1H-Benzimidazol-2-Yl)Sulfinyl]Methyl}-N,N-Dimethylaniline

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Properties Simple | Detailed

Formula C17H19N3O2S
IUPAC Name 2-[[(s)-(5-methoxybenzimidazol-3-ium-2-ylium-2-yl)sulfinyl]methyl]-n,n-dimethyl-aniline
Molecular Mass 329.417 g·mol−1
Heat of Formation 19.9 ± 16.7 kJ·mol−1
Dipole Moment 1.13 ± 1.08 D
Volume 389.53 Å 3
Surface Area 349.94 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 2.67 ± eV
Point Group Symmetry C1
InChIKey XEACPNJGCWYTPJ-QHCPKHFHSA-N
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