Geometry & MOs

Info

ID:	123382
PubChem CID:	50845058
Reduced:	ClFS2O3N4C21H22 (1)
Stoich.:	ABC2D3E4F21G22 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	-111.45
Dipole, Da:	12.09
IP(EA), eV:	-8.67(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethylanilino)-N-(4-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2=CC(=CN2CC(=O)N3CCCCC3)S(=O)(=O)NC4=CC(=C(C=C4)F)Cl

DOS

IR

Vibrations