Geometry & MOs

Info

ID:	201441
PubChem CID:	79540990
Reduced:	FNO2C15H18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	241.167794
ΔH_f, kcal/mol:	-129.28
Dipole, Da:	4.87
IP(EA), eV:	-9.47(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-oxopropyl)pyrrolidin-1-yl]-3-propoxypropan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)C(=O)N2CCCC2CC(=O)C

DOS

IR

Vibrations