Geometry & MOs

Info

ID:	366975
PubChem CID:	127322429
Reduced:	SN2O2C14H26 (1)
Stoich.:	AB2C2D14E26 (1)
Weight, g/mol:	383.122501
ΔH_f, kcal/mol:	-100.72
Dipole, Da:	3.81
IP(EA), eV:	-9.27(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-5-methylsulfonylphenyl)sulfonyl-2-azaspiro[5.5]undec-9-ene

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)N1CCCC2(C1)CCC=CC2

DOS

IR

Vibrations