Geometry & MOs

Info

ID:	121878
PubChem CID:	50785153
Reduced:	ClSO2N5C17H18 (1)
Stoich.:	ABC2D5E17F18 (1)
Weight, g/mol:	375.116524
ΔH_f, kcal/mol:	-26.63
Dipole, Da:	5.51
IP(EA), eV:	-8.92(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC)C1=NC2=C(S1)C(=O)N(C=N2)CC(=O)NC3=CC=CC=C3Cl

DOS

IR

Vibrations