Geometry & MOs

Info

ID:	275386
PubChem CID:	103815630
Reduced:	BrON3C15H22 (1)
Stoich.:	ABC3D15E22 (1)
Weight, g/mol:	302.04523
ΔH_f, kcal/mol:	-31.36
Dipole, Da:	3.79
IP(EA), eV:	-8.97(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromothiophen-2-yl)methyl]-N-methyl-1-piperidin-3-ylmethanamine

Drug info:

PubChemData

Smile

CN(CC1CCCNC1)CC(=O)NC2=CC=CC=C2Br

DOS

IR

Vibrations