Geometry & MOs

Info

ID:	369893
PubChem CID:	127336665
Reduced:	SN2O2C8H11 (2)
Stoich.:	AB2C2D8E11 (2)
Weight, g/mol:	392.042454
ΔH_f, kcal/mol:	-114.49
Dipole, Da:	3.64
IP(EA), eV:	-9.27(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-difluorophenyl)sulfonyl-4-(1H-imidazol-5-ylsulfonyl)piperazine

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CN=CN3

DOS

IR

Vibrations