Geometry & MOs

Info

ID:	441519
PubChem CID:	135235655
Reduced:	N2O3H20C21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	356.01604
ΔH_f, kcal/mol:	-39.55
Dipole, Da:	5.82
IP(EA), eV:	-8.73(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenoxy)-3-(4-methoxypyridin-3-yl)pyridine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=C(N=CC=C2)OC3=CC4=C(C(CCC4)O)N=C3

DOS

IR

Vibrations