Geometry & MOs

Info

ID:	143142
PubChem CID:	53153273
Reduced:	ClSN4O4H15C17 (1)
Stoich.:	ABC4D4E15F17 (1)
Weight, g/mol:	360.06924
ΔH_f, kcal/mol:	-72.72
Dipole, Da:	3.79
IP(EA), eV:	-8.78(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-cyclopropyl-5,7-dioxo-[1,2]thiazolo[4,3-d]pyrimidin-4-yl)-N-(2-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)Cl)NC(=O)CN2C3=CSN=C3C(=O)N(C2=O)C4CC4

DOS

IR

Vibrations