Geometry & MOs

Info

ID:	265467
PubChem CID:	103523808
Reduced:	BrNO2C16H24 (1)
Stoich.:	ABC2D16E24 (1)
Weight, g/mol:	297.03644
ΔH_f, kcal/mol:	-68.51
Dipole, Da:	2.21
IP(EA), eV:	-8.84(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-bromo-2,4-dimethoxyphenyl)-1,2,3,6-tetrahydropyridine

Drug info:

PubChemData

Smile

CNC1CCCCCC1C2=C(C(=C(C=C2)OC)Br)OC

DOS

IR

Vibrations