Geometry & MOs

Info

ID:	330728
PubChem CID:	127248135
Reduced:	SO4N5C20H23 (1)
Stoich.:	AB4C5D20E23 (1)
Weight, g/mol:	389.210327
ΔH_f, kcal/mol:	-49.11
Dipole, Da:	8.62
IP(EA), eV:	-9.22(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(2-phenylethyl)-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1(CCN(C1)S(=O)(=O)C2=CN(C=N2)C)CC3=CC(=NO3)C4=CC=CC=C4

DOS

IR

Vibrations