Geometry & MOs

Info

ID:	289899
PubChem CID:	104384985
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	364.0762
ΔH_f, kcal/mol:	-32.32
Dipole, Da:	1.56
IP(EA), eV:	-8.61(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-bromo-3-(trifluoromethyl)phenyl]methyl]-2-piperidin-1-ylethanamine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCCNCCN2CCCC2

DOS

IR

Vibrations