Geometry & MOs

Info

ID:	67688
PubChem CID:	46506970
Reduced:	SO2N4C17H18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	569.180684
ΔH_f, kcal/mol:	-36.39
Dipole, Da:	9.15
IP(EA), eV:	-8.95(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(2-ethoxyphenyl)-3-(4-ethylphenyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-(4-ethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)NC1=S

DOS

IR

Vibrations