Geometry & MOs

Info

ID:	196382
PubChem CID:	78817783
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	419.199111
ΔH_f, kcal/mol:	-14.95
Dipole, Da:	6.45
IP(EA), eV:	-8.55(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methyl-3-piperidin-1-ylsulfonylanilino)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NCC2=CN3C=CC=CC3=N2)S(=O)(=O)N4CCCCC4

DOS

IR

Vibrations