Geometry & MOs

Info

ID:	355823
PubChem CID:	127290675
Reduced:	SO4N6C15H22 (1)
Stoich.:	AB4C6D15E22 (1)
Weight, g/mol:	352.168145
ΔH_f, kcal/mol:	-111.57
Dipole, Da:	3.28
IP(EA), eV:	-8.56(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-methylpyrazol-4-yl)methyl]-4-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperazine

Drug info:

PubChemData

Smile

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)N2CCN(CC2)CC3=CN(N=C3)C

DOS

IR

Vibrations