Geometry & MOs

Info

ID:	389154
PubChem CID:	134991344
Reduced:	PdP2C24H38 (1)
Stoich.:	AB2C24D38 (1)
Weight, g/mol:	194.203451
ΔH_f, kcal/mol:	39.31
Dipole, Da:	1.38
IP(EA), eV:	-6.98(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-2-hexyl-1-methyl-3-methylidenecyclohexane

Drug info:

PubChemData

Smile

CCP(CC)CC.CCP(CC)CC.C1=CC=C([C-]=C1)C2=CC=CC=[C-]2.[Pd+2]

DOS

IR

Vibrations