Geometry & MOs

Info

ID:	192446
PubChem CID:	78270324
Reduced:	SO3N5C18H24 (1)
Stoich.:	AB3C5D18E24 (1)
Weight, g/mol:	389.152161
ΔH_f, kcal/mol:	-25.18
Dipole, Da:	4.48
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.878786
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylsulfamoyl)-N-(5-methyl-2-pyridin-2-ylpyrazolidin-3-yl)benzamide

Drug info:

PubChemData

Smile

CC1CC([NH+](N1)C2=CC=CC=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

DOS

IR

Vibrations