Tert-Butyl 2-[(4-Chlorophenyl)Methyl-[(5-Nitro-2-Thienyl)Methyl]Amino]Acetate

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Formula C18H21ClN2O4S
IUPAC Name tert-butyl 2-[(4-chlorophenyl)methyl-[(5-nitro-2-thienyl)methyl]amino]acetate
Molecular Mass 396.888 g·mol−1
Heat of Formation -292.3 ± 16.7 kJ·mol−1
Dipole Moment 9.12 ± 1.08 D
Volume 461.67 Å 3
Surface Area 382.73 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy -1.51 ± eV
Point Group Symmetry C1
InChIKey WJUYNQIIUZDZFN-UHFFFAOYSA-N
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