Geometry & MOs

Info

ID:	142358
PubChem CID:	53021015
Reduced:	ClSN3O3C23H24 (1)
Stoich.:	ABC3D3E23F24 (1)
Weight, g/mol:	427.153206
ΔH_f, kcal/mol:	-58.96
Dipole, Da:	5.1
IP(EA), eV:	-8.43(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(2-methoxyphenoxy)pyrimidin-4-yl]-N-(3-methoxyphenyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1Cl)OC)NC2=CC(=NC3=C2C=CC=C3OC)C(=O)N4CCSCC4

DOS

IR

Vibrations