Geometry & MOs

Info

ID:	123389
PubChem CID:	50845506
Reduced:	SF2O2N3H15C18 (1)
Stoich.:	AB2C2D3E15F18 (1)
Weight, g/mol:	401.119798
ΔH_f, kcal/mol:	-100.57
Dipole, Da:	4.44
IP(EA), eV:	-8.87(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anilino-4-methyl-N-(4-phenoxyphenyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC2=C(C=CC=N2)S(=O)(=O)NC3=CC=C(C=C3)F)F

DOS

IR

Vibrations