(2S,3R,4R,5R)-N-(4-Carbamoyl-2-Methoxyphenyl)-2'-Chloro-4-(3-Chloro-2-Fluorophenyl)-2-(2,2-Dimethylpropyl)-5'-Oxo-4',5'-Dihydrospiro[Pyrrolidine-3,6'-Thieno[3,2-B]Pyrrole]-5-Carboxamide

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Properties Simple | Detailed

Formula C29H29Cl2FN4O4S
IUPAC Name (2'r,3'r,5's,6r)-n-(4-carbamoyl-2-methoxy-phenyl)-2-chloro-3'-(3-chloro-2-fluoro-phenyl)-5'-(2,2-dimethylpropyl)-5-oxo-spiro[4h-thieno[3,2-b]pyrrole-6,4'-pyrrolidine]-2'-carboxamide
Molecular Mass 619.534 g·mol−1
Heat of Formation -655.2 ± 16.7 kJ·mol−1
Dipole Moment 6.11 ± 1.08 D
Volume 681.67 Å 3
Surface Area 518.19 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 1.81 ± eV
Point Group Symmetry C1
InChIKey UOVSZRTTWLJPHE-HNXAPSNLSA-N
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Elements C Cl H F O N S