Geometry & MOs

Info

ID:	137394
PubChem CID:	52203561
Reduced:	ClSN2F3O3H14C17 (1)
Stoich.:	ABC2D3E3F14G17 (1)
Weight, g/mol:	362.145342
ΔH_f, kcal/mol:	-234.14
Dipole, Da:	3.5
IP(EA), eV:	-8.71(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-N-[(2S)-3-methyl-1-oxo-1-(2,2,2-trifluoroethylamino)butan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NCC(F)(F)F)Cl

DOS

IR

Vibrations