Geometry & MOs

Info

ID:	144013
PubChem CID:	53299704
Reduced:	N2O2C16H27 (2)
Stoich.:	A2B2C16D27 (2)
Weight, g/mol:	357.103479
ΔH_f, kcal/mol:	-232.68
Dipole, Da:	12.74
IP(EA), eV:	-9.57(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R,3S)-3-(4-methoxyphenyl)sulfanyl-5-oxo-2-phenylpyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)C[C@H]1CN(C(=O)C(=O)N1CCC2CCCCC2)CCCC[C@H]3CNC(=O)C(=O)N3CCC4CCCCC4

DOS

IR

Vibrations