Geometry & MOs

Info

ID:	394138
PubChem CID:	135022408
Reduced:	SN3O9C36H39 (1)
Stoich.:	AB3C9D36E39 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-283.61
Dipole, Da:	4.39
IP(EA), eV:	-8.75(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,6,8-trimethyl-2-[(4-methylphenyl)methyl]-5,7-dioxa-2-azaspiro[3.4]octane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2OCOC)C3=C(C(=CC=C3)NC(=O)C4CCCN4C(=O)OCC5=CC=CC=C5)OCOC

DOS

IR

Vibrations