Geometry & MOs

Info

ID:	12497
PubChem CID:	138842
Reduced:	H5C6 (2)
Stoich.:	A5B6 (2)
Weight, g/mol:	154.07825
ΔH_f, kcal/mol:	57.35
Dipole, Da:	0.92
IP(EA), eV:	-8.85(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dihydrocyclobuta[b]naphthalene

Drug info:

PubChemData

Smile

C1CC2=CC3=CC=CC=C3C=C21

DOS

IR

Vibrations