Geometry & MOs

Info

ID:	267271
PubChem CID:	103581584
Reduced:	BrClON2C14H20 (1)
Stoich.:	ABCD2E14F20 (1)
Weight, g/mol:	358.08114
ΔH_f, kcal/mol:	-43.86
Dipole, Da:	6.66
IP(EA), eV:	-9.42(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromo-3-chlorophenyl)methyl]-1-tert-butylpiperidin-4-amine

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CCNCC1=CC(=C(C=C1)Br)Cl

DOS

IR

Vibrations