Geometry & MOs

Info

ID:	131666
PubChem CID:	51240051
Reduced:	O4N5C19H21 (1)
Stoich.:	A4B5C19D21 (1)
Weight, g/mol:	344.096141
ΔH_f, kcal/mol:	-59.72
Dipole, Da:	3.33
IP(EA), eV:	-8.71(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methyl]-1-propylsulfonylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=NN(C(=O)C=C3)CCOC

DOS

IR

Vibrations