Geometry & MOs

Info

ID:	22196
PubChem CID:	596232
Reduced:	OC11H16 (1)
Stoich.:	AB11C16 (1)
Weight, g/mol:	164.120115
ΔH_f, kcal/mol:	15.09
Dipole, Da:	4.55
IP(EA), eV:	-9.41(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tricyclo[5.3.1.04,9]undecan-2-one

Drug info:

PubChemData

Smile

C1CC2CC(=O)C3CC1CC2C3

DOS

IR

Vibrations