Geometry & MOs

Info

ID:	192886
PubChem CID:	78322132
Reduced:	FON3H16C22 (1)
Stoich.:	ABC3D16E22 (1)
Weight, g/mol:	394.098728
ΔH_f, kcal/mol:	16.87
Dipole, Da:	1.08
IP(EA), eV:	-8.83(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C(=N2)/C=C/C3=CC=C(C=C3)F)C4=CC=CC(=C4)N

DOS

IR

Vibrations