Geometry & MOs

Info

ID:	425727
PubChem CID:	135127616
Reduced:	NO2H13C19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	226.168128
ΔH_f, kcal/mol:	-4.4
Dipole, Da:	5.07
IP(EA), eV:	-8.26(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-hydroxypyrrolidin-1-yl)butan-2-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C=C1)OC(=O)C3=C2C=C4C5=CC=CC=C5NC4=C3

DOS

IR

Vibrations