Geometry & MOs

Info

ID:	295767
PubChem CID:	117543772
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	247.157229
ΔH_f, kcal/mol:	-92.67
Dipole, Da:	3.57
IP(EA), eV:	-8.51(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-methoxy-5-methylphenyl)methyl]-2,2-dimethylpyrrolidin-3-one

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=C1)CN2CCC(C2(C)C)O)OC

DOS

IR

Vibrations