Geometry & MOs

Info

ID:	345047
PubChem CID:	127268807
Reduced:	SN2O3C18H32 (1)
Stoich.:	AB2C3D18E32 (1)
Weight, g/mol:	394.156243
ΔH_f, kcal/mol:	-171.32
Dipole, Da:	5.66
IP(EA), eV:	-9.06(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[4-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(CC1)CS(=O)(=O)N2CCN(CC2)C(=O)C3CCCCC3

DOS

IR

Vibrations