Geometry & MOs

Info

ID:	280863
PubChem CID:	103851664
Reduced:	SN2O2F4C12H16 (1)
Stoich.:	AB2C2D4E12F16 (1)
Weight, g/mol:	260.130697
ΔH_f, kcal/mol:	-273.97
Dipole, Da:	8.11
IP(EA), eV:	-9.82(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-ethylethanesulfonamide

Drug info:

PubChemData

Smile

CCNS(=O)(=O)CCNCC1=CC(=C(C=C1)F)C(F)(F)F

DOS

IR

Vibrations