Geometry & MOs

Info

ID:	387689
PubChem CID:	134986446
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	248.02343
ΔH_f, kcal/mol:	-88.64
Dipole, Da:	1.53
IP(EA), eV:	-9.05(1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,8R)-9-bromo-9-methylsulfanylbicyclo[6.1.0]nonane

Drug info:

PubChemData

Smile

CCC1C(C12OCCO2)(C)CC

DOS

IR

Vibrations