Geometry & MOs

Info

ID:	196612
PubChem CID:	78853623
Reduced:	FSN2O3C24H31 (1)
Stoich.:	ABC2D3E24F31 (1)
Weight, g/mol:	354.120213
ΔH_f, kcal/mol:	-150.9
Dipole, Da:	7.63
IP(EA), eV:	-9.46(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethylphenyl)-N-ethyl-2-(4-fluorophenyl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N(CCC2=CC=C(C=C2)F)C3CCCC3

DOS

IR

Vibrations