Geometry & MOs

Info

ID:	204099
PubChem CID:	79911547
Reduced:	NSO2C15H29 (1)
Stoich.:	ABC2D15E29 (1)
Weight, g/mol:	282.074822
ΔH_f, kcal/mol:	-123.42
Dipole, Da:	4.92
IP(EA), eV:	-8.33(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6-oxa-2-thiaspiro[4.5]decan-9-ylsulfanyl)phenol

Drug info:

PubChemData

Smile

CCNC(C1CCOC2(C1)CCSCC2)C(C)OC

DOS

IR

Vibrations