Geometry & MOs

Info

ID:	293994
PubChem CID:	117421431
Reduced:	SN3O3C11H13 (1)
Stoich.:	AB3C3D11E13 (1)
Weight, g/mol:	267.067762
ΔH_f, kcal/mol:	-75.24
Dipole, Da:	6.26
IP(EA), eV:	-8.81(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-methoxy-4-methylsulfonylphenyl)-1H-pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1O)C2=CC(=NN2)N)S(=O)(=O)C

DOS

IR

Vibrations