Geometry & MOs

Info

ID:	386771
PubChem CID:	134982886
Reduced:	OSH7C12 (2)
Stoich.:	ABC7D12 (2)
Weight, g/mol:	292.219101
ΔH_f, kcal/mol:	115.32
Dipole, Da:	1.03
IP(EA), eV:	-8.52(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E,8aS)-3-[(4aS)-4a-methyl-3,4,5,6-tetrahydronaphthalen-2-ylidene]-8a-methyl-1,2,7,8-tetrahydronaphthalene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=C(O3)C4=CC=C(S4)/C=C\C5=CC=C(S5)C6=CC=C2O6

DOS

IR

Vibrations