Geometry & MOs

Info

ID:	79335
PubChem CID:	49748135
Reduced:	N2S2O4C21H26 (1)
Stoich.:	A2B2C4D21E26 (1)
Weight, g/mol:	437.107913
ΔH_f, kcal/mol:	-132.37
Dipole, Da:	10.25
IP(EA), eV:	-8.8(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methylphenyl)sulfonyl-8-pyridin-3-ylsulfonyl-1-oxa-4,8-diazaspiro[4.5]decane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCOC23CCN(CC3)C(=O)CCC4=CSC=C4

DOS

IR

Vibrations