Geometry & MOs

Info

ID:	201439
PubChem CID:	79540988
Reduced:	NSO2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	221.105193
ΔH_f, kcal/mol:	-79.03
Dipole, Da:	5.33
IP(EA), eV:	-9.27(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(furan-2-carbonyl)pyrrolidin-2-yl]propan-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)N2CCCC2CC(=O)C

DOS

IR

Vibrations