Geometry & MOs

Info

ID:	161860
PubChem CID:	57392871
Reduced:	SO3N4C23H26 (1)
Stoich.:	AB3C4D23E26 (1)
Weight, g/mol:	452.188212
ΔH_f, kcal/mol:	-53.44
Dipole, Da:	5.83
IP(EA), eV:	-9.01(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-5-[(4-methylphenyl)sulfonylamino]-1-phenylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=NN2C3=CC=CC=C3)C(=O)NC4CCCCC4

DOS

IR

Vibrations