Geometry & MOs

Info

ID:	60874
PubChem CID:	26702779
Reduced:	SF2N3O4H19C23 (1)
Stoich.:	AB2C3D4E19F23 (1)
Weight, g/mol:	387.125277
ΔH_f, kcal/mol:	-189.64
Dipole, Da:	5.93
IP(EA), eV:	-8.5(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-diethoxyphenyl)-3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC3=CC(=C(C=C3)OC(F)F)C4=CC=C(C=C4)OC

DOS

IR

Vibrations