Geometry & MOs

Info

ID:	284710
PubChem CID:	104062877
Reduced:	ON4C16H16 (1)
Stoich.:	AB4C16D16 (1)
Weight, g/mol:	266.116761
ΔH_f, kcal/mol:	65.8
Dipole, Da:	6.11
IP(EA), eV:	-8.35(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(3-methoxypyridin-2-yl)pyrazol-4-yl]aniline

Drug info:

PubChemData

Smile

CCOC1=C(N=CC=C1)N2C=C(C=N2)C3=CC(=CC=C3)N

DOS

IR

Vibrations