Geometry & MOs

Info

ID:	295801
PubChem CID:	117544310
Reduced:	NO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	235.137242
ΔH_f, kcal/mol:	-94.69
Dipole, Da:	3.63
IP(EA), eV:	-8.67(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-fluorophenyl)methyl]-6,6-dimethylpiperidin-3-one

Drug info:

PubChemData

Smile

CC1(CCC(=O)CN1CC2=CC3=C(C=C2)OCO3)C

DOS

IR

Vibrations