Geometry & MOs

Info

ID:	144197
PubChem CID:	53331613
Reduced:	SF2N2O2H12C19 (1)
Stoich.:	AB2C2D2E12F19 (1)
Weight, g/mol:	370.058755
ΔH_f, kcal/mol:	-93.02
Dipole, Da:	4.82
IP(EA), eV:	-9.06(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-fluorophenyl)-1-[(3-fluorophenyl)methyl]thieno[3,2-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN2C3=C(C(=O)N(C2=O)C4=CC(=CC=C4)F)SC=C3)F

DOS

IR

Vibrations