Geometry & MOs

Info

ID:	20671
PubChem CID:	585103
Reduced:	OC13H20 (1)
Stoich.:	AB13C20 (1)
Weight, g/mol:	192.151415
ΔH_f, kcal/mol:	-61.03
Dipole, Da:	3.53
IP(EA), eV:	-9.59(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,9-dimethyltricyclo[6.3.0.01,5]undecan-4-one

Drug info:

PubChemData

Smile

CC1CCC23C1CCC2(C(=O)CC3)C

DOS

IR

Vibrations