Geometry & MOs

Info

ID:	260730
PubChem CID:	103201941
Reduced:	O2N3H11C13 (1)
Stoich.:	A2B3C11D13 (1)
Weight, g/mol:	251.046154
ΔH_f, kcal/mol:	22.96
Dipole, Da:	2.62
IP(EA), eV:	-8.44(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-chloropyrimidin-2-yl)oxy-2-methoxyaniline

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)OC2=C(C=CN=C2)C#N)N

DOS

IR

Vibrations