Geometry & MOs

Info

ID:	345176
PubChem CID:	127268936
Reduced:	SN2O5C18H26 (1)
Stoich.:	AB2C5D18E26 (1)
Weight, g/mol:	324.161997
ΔH_f, kcal/mol:	-195.62
Dipole, Da:	7.8
IP(EA), eV:	-9.11(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(cyclohexylmethylsulfonyl)piperazin-1-yl]pyridazine

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)NCCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

DOS

IR

Vibrations