Geometry & MOs

Info

ID:	389534
PubChem CID:	134993513
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	162.140851
ΔH_f, kcal/mol:	-14.47
Dipole, Da:	4.01
IP(EA), eV:	-9.48(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2aS,5aS)-3,4,5,5a,6,7,8,9-octahydro-2aH-cyclobuta[j]naphthalene

Drug info:

PubChemData

Smile

C/C=C/[C@]12CC(=O)CC[C@H]1CCC2=C=C

DOS

IR

Vibrations