Geometry & MOs

Info

ID:	273321
PubChem CID:	103770908
Reduced:	NO2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	320.176979
ΔH_f, kcal/mol:	-106.3
Dipole, Da:	2.37
IP(EA), eV:	-9.55(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-1-propylsulfonylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1(CCCC1)C2=CC=CC=C2)O

DOS

IR

Vibrations