Geometry & MOs

Info

ID:	3760
PubChem CID:	10129
Reduced:	C5H9 (2)
Stoich.:	A5B9 (2)
Weight, g/mol:	138.140851
ΔH_f, kcal/mol:	-18.62
Dipole, Da:	0.28
IP(EA), eV:	-10.01(3.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6,6-trimethylbicyclo[3.1.1]heptane

Drug info:

PubChemData

Smile

CC1CCC2CC1C2(C)C

DOS

IR

Vibrations