Geometry & MOs

Info

ID:	28546
PubChem CID:	828297
Reduced:	NPO2H14C17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	198.082684
ΔH_f, kcal/mol:	-62.5
Dipole, Da:	4.67
IP(EA), eV:	-8.49(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2-sulfanylidene-1,3-diazaspiro[4.5]decan-4-one

Drug info:

PubChemData

Smile

COP1(=O)C2=CC=CC=C2NC3=C1C4=CC=CC=C4C=C3

DOS

IR

Vibrations