Geometry & MOs

Info

ID:	342784
PubChem CID:	127265947
Reduced:	NSO2C6H10 (2)
Stoich.:	ABC2D6E10 (2)
Weight, g/mol:	348.086781
ΔH_f, kcal/mol:	-156.38
Dipole, Da:	1.68
IP(EA), eV:	-9.92(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-[2-[4-(trifluoromethyl)pyridin-2-yl]ethyl]pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)NCCCCS(=O)(=O)N

DOS

IR

Vibrations