Geometry & MOs

Info

ID:	295779
PubChem CID:	117543972
Reduced:	FNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	251.132157
ΔH_f, kcal/mol:	-111.96
Dipole, Da:	3.62
IP(EA), eV:	-8.83(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-fluoro-2-methoxyphenyl)methyl]-5,5-dimethylpyrrolidin-3-one

Drug info:

PubChemData

Smile

CC1(CC(=O)CN1CC2=CC(=C(C=C2)OC)F)C

DOS

IR

Vibrations