Geometry & MOs

Info

ID:	294012
PubChem CID:	117422067
Reduced:	FNO2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	267.163457
ΔH_f, kcal/mol:	-125.58
Dipole, Da:	3.44
IP(EA), eV:	-8.68(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(fluoromethyl)-4,5-dimethoxyphenyl]methyl]piperidine

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1F)C)OC)OC)CC2CCCN2

DOS

IR

Vibrations