Ethyl (3R)-3-[[(4-Chlorophenyl)Methyl-[(5-Nitro-2-Thienyl)Methyl]Amino]Methyl]Pyrrolidine-1-Carboxylate

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Formula C20H24ClN3O4S
IUPAC Name ethyl (3r)-3-[[(4-chlorophenyl)methyl-[(5-nitro-2-thienyl)methyl]amino]methyl]pyrrolidine-1-carboxylate
Molecular Mass 437.940 g·mol−1
Heat of Formation -258.9 ± 16.7 kJ·mol−1
Dipole Moment 8.87 ± 1.08 D
Volume 511.39 Å 3
Surface Area 390.6 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 1.46 ± eV
Point Group Symmetry C1
InChIKey UYIIPFTWBRSRAL-MRXNPFEDSA-N
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