Geometry & MOs

Info

ID:	203960
PubChem CID:	79893717
Reduced:	NSO2C13H23 (1)
Stoich.:	ABC2D13E23 (1)
Weight, g/mol:	210.16198
ΔH_f, kcal/mol:	-110.08
Dipole, Da:	4.16
IP(EA), eV:	-8.43(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-oxaspiro[3.5]nonan-8-yl)pentan-2-one

Drug info:

PubChemData

Smile

C1CC(NC1)COC2CCOC3(C2)CCSC3

DOS

IR

Vibrations