1-({5-[(3As,4S,6As)-2-Oxohexahydro-1H-Thieno[3,4-D]Imidazol-4-Yl]Pentanoyl}Oxy)-2,5-Pyrrolidinedione

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Properties Simple | Detailed

Formula C14H19N3O5S
IUPAC Name (2,5-dioxopyrrolidin-1-yl) 5-[(3ar,4s,6as)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoate
Molecular Mass 341.383 g·mol−1
Heat of Formation -756.4 ± 16.7 kJ·mol−1
Dipole Moment 5.76 ± 1.08 D
Volume 389.05 Å 3
Surface Area 333.31 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
InChIKey YMXHPSHLTSZXKH-VYUIOLGVSA-N
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