Geometry & MOs

Info

ID:	199866
PubChem CID:	79310554
Reduced:	NF2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	279.1987
ΔH_f, kcal/mol:	-61.97
Dipole, Da:	1.42
IP(EA), eV:	-9.12(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzyl-4-(2,5-dimethylphenyl)piperidine

Drug info:

PubChemData

Smile

C1CNCC(C1C2=C(C=C(C=C2)F)F)CC3=CC=CC=C3

DOS

IR

Vibrations