Geometry & MOs

Info

ID:	70398
PubChem CID:	48413290
Reduced:	SN4O4C19H28 (1)
Stoich.:	AB4C4D19E28 (1)
Weight, g/mol:	419.162725
ΔH_f, kcal/mol:	-94.09
Dipole, Da:	3.33
IP(EA), eV:	-8.26(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-dimethoxyphenyl)methyl]-1,3,5-trimethyl-N-(1-methylpyrazol-4-yl)pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)N(CC2=C(C=CC(=C2)OC)OC)S(=O)(=O)N3CCCCCC3

DOS

IR

Vibrations