Geometry & MOs

Info

ID:	19172
PubChem CID:	556528
Reduced:	OC13H18 (1)
Stoich.:	AB13C18 (1)
Weight, g/mol:	190.135765
ΔH_f, kcal/mol:	-24.23
Dipole, Da:	2.73
IP(EA), eV:	-9.64(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-4-(2-methylprop-2-enyl)tricyclo[3.3.0.02,8]octan-3-one

Drug info:

PubChemData

Smile

CC(=C)CC1(C2CCC3C2C3C1=O)C

DOS

IR

Vibrations