Geometry & MOs

Info

ID:	70392
PubChem CID:	48413283
Reduced:	SN3O4C14H19 (1)
Stoich.:	AB3C4D14E19 (1)
Weight, g/mol:	396.183127
ΔH_f, kcal/mol:	-96.29
Dipole, Da:	2.84
IP(EA), eV:	-8.35(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[butyl(methyl)sulfamoyl]-N-[(2,5-dimethoxyphenyl)methyl]-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations