Geometry & MOs

Info

ID:	157401
PubChem CID:	56423825
Reduced:	SN5O5C18H21 (1)
Stoich.:	AB5C5D18E21 (1)
Weight, g/mol:	342.101369
ΔH_f, kcal/mol:	-135.58
Dipole, Da:	13.48
IP(EA), eV:	-9.26(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[2-methyl-2-[3-(trifluoromethyl)phenyl]propyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C2=NN=C(C=C2)N3CCCC3

DOS

IR

Vibrations