Geometry & MOs

Info

ID:	293370
PubChem CID:	117386330
Reduced:	FNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	253.147807
ΔH_f, kcal/mol:	-126.98
Dipole, Da:	1.34
IP(EA), eV:	-8.69(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1O)OC)F)CC2CCCCN2

DOS

IR

Vibrations