Geometry & MOs

Info

ID:	135340
PubChem CID:	51853462
Reduced:	SO2F3N5C14H20 (1)
Stoich.:	AB2C3D5E14F20 (1)
Weight, g/mol:	379.128981
ΔH_f, kcal/mol:	-187.74
Dipole, Da:	12.15
IP(EA), eV:	-9.55(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-methyl-N-[(2S)-2-methyl-3-[3-(trifluoromethyl)pyrazol-1-yl]propyl]pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C[C@@H](C)CNS(=O)(=O)C2=C(N(N=C2)C)C)C(F)(F)F

DOS

IR

Vibrations