Geometry & MOs

Info

ID:	146515
PubChem CID:	53699666
Reduced:	ClSN2O6H9C12 (1)
Stoich.:	ABC2D6E9F12 (1)
Weight, g/mol:	203.055798
ΔH_f, kcal/mol:	-168.61
Dipole, Da:	8.64
IP(EA), eV:	-9.29(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=NNC2=C(C=CC(=C2O)S(=O)(=O)O)Cl)C(=CC1=O)O

DOS

IR

Vibrations