1-Cyano-2-Methyl-3-(2-{[(4-Methyl-1H-Imidazol-5-Yl)Methyl]Sulfinyl}Ethyl)Guanidine

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Properties Simple | Detailed

Formula C10H16N6OS
IUPAC Name 1-cyano-2-methyl-3-[2-[(r)-(5-methylimidazol-1-ium-5-ylium-4-yl)methylsulfinyl]ethyl]guanidine
Molecular Mass 268.339 g·mol−1
Heat of Formation 188.5 ± 16.7 kJ·mol−1
Dipole Moment 4.34 ± 1.08 D
Volume 322.43 Å 3
Surface Area 301.46 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 3.36 ± eV
Point Group Symmetry C1
InChIKey HOJLJLYVNQFCRE-GOSISDBHSA-N
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