3-({2-[(Diaminomethylene)Amino]Ethyl}Sulfanyl)-2-(Sulfanylmethyl)Propanoic Acid

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Formula C7H15N3O2S2
IUPAC Name (2r)-2-(2-guanidinoethylsulfanylmethyl)-3-sulfanyl-propanoic acid
Molecular Mass 237.343 g·mol−1
Heat of Formation -345.5 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 281.58 Å 3
Surface Area 263.26 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
InChIKey AKPKWZRKZOAAAZ-RXMQYKEDSA-N
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