Geometry & MOs

Info

ID:	141090
PubChem CID:	52816871
Reduced:	SN2O3C23H26 (1)
Stoich.:	AB2C3D23E26 (1)
Weight, g/mol:	441.098097
ΔH_f, kcal/mol:	-71.79
Dipole, Da:	4.67
IP(EA), eV:	-8.67(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenyl)-N-[4-(2-oxo-2-thiomorpholin-4-ylethyl)phenyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC1COC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC(=O)N4CCSCC4

DOS

IR

Vibrations