Geometry & MOs

Info

ID:	151174
PubChem CID:	53790874
Reduced:	ClO2F3H20C23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	235.112777
ΔH_f, kcal/mol:	-169.74
Dipole, Da:	5.67
IP(EA), eV:	-9.0(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-chlorophenyl)prop-1-en-2-yl]piperidine

Drug info:

PubChemData

Smile

CC(C)(CCC1=CC(=C(C=C1)F)OC2=CC=CC=C2F)OC3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations