Geometry & MOs

Info

ID:	396114
PubChem CID:	135027423
Reduced:	OC14H20 (1)
Stoich.:	AB14C20 (1)
Weight, g/mol:	340.142307
ΔH_f, kcal/mol:	-45.42
Dipole, Da:	2.41
IP(EA), eV:	-9.04(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R,3S,4R,5R)-5-(3-methylphenyl)-4-nitro-3-phenylpyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)/C=C/[C@H](CC(C)C)O

DOS

IR

Vibrations