6-{[5-(2-Amino-3A,4,6,6A-Tetrahydro-1H-Thieno[3,4-D]Imidazol-4-Yl)Pentanoyl]Amino}Hexanoic Acid

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Formula C16H28N4O3S
IUPAC Name 6-[5-[(3as,4s,6ar)-2-imino-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanoic acid
Molecular Mass 356.484 g·mol−1
Heat of Formation -612.9 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 444.89 Å 3
Surface Area 409.48 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 2.50 ± eV
Point Group Symmetry C1
InChIKey IAJKFHSLWUNBII-HUBLWGQQSA-N
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