Geometry & MOs

Info

ID:	200855
PubChem CID:	79454249
Reduced:	BrClC14H20 (1)
Stoich.:	ABC14D20 (1)
Weight, g/mol:	253.123342
ΔH_f, kcal/mol:	-25.98
Dipole, Da:	1.36
IP(EA), eV:	-9.59(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-chlorophenyl)-4-(methoxymethyl)-4-methylpiperidine

Drug info:

PubChemData

Smile

CC(C)(C)CCC(CCl)C1=CC=CC=C1Br

DOS

IR

Vibrations