Geometry & MOs

Info

ID:	396330
PubChem CID:	135028069
Reduced:	OC6H7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	154.09938
ΔH_f, kcal/mol:	-75.18
Dipole, Da:	5.32
IP(EA), eV:	-9.61(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5R)-2-hydroxybicyclo[3.3.1]nonan-9-one

Drug info:

PubChemData

Smile

CC1(COC(=O)C1C2=CC=CC=C2)C

DOS

IR

Vibrations