Geometry & MOs

Info

ID:	120946
PubChem CID:	50751690
Reduced:	SN4O4C20H28 (1)
Stoich.:	AB4C4D20E28 (1)
Weight, g/mol:	428.151826
ΔH_f, kcal/mol:	-127.37
Dipole, Da:	3.55
IP(EA), eV:	-9.04(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethylphenyl)-3-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(C1C)NC(=O)C2=CC(=NN2)C3=CC(=C(C=C3)OC)S(=O)(=O)NC

DOS

IR

Vibrations