Geometry & MOs

Info

ID:	281993
PubChem CID:	103914643
Reduced:	O3N4C16H30 (1)
Stoich.:	A3B4C16D30 (1)
Weight, g/mol:	338.13576
ΔH_f, kcal/mol:	-134.42
Dipole, Da:	4.39
IP(EA), eV:	-8.89(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(2-bromophenyl)ethyl]-1-(2-methylpropyl)piperidin-4-amine

Drug info:

PubChemData

Smile

CC(C1=NC=CN1C)NCCN(CCOC)C(=O)OC(C)(C)C

DOS

IR

Vibrations