Geometry & MOs

Info

ID:	402084
PubChem CID:	135054270
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	467.207214
ΔH_f, kcal/mol:	-79.65
Dipole, Da:	6.47
IP(EA), eV:	-9.6(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R,3R,5S)-3,5-diphenyl-2-[4-(trifluoromethyl)phenyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

C1C[C@@H](NC(=O)C1)[C@@H](C2=CC=CC=C2)O

DOS

IR

Vibrations