Geometry & MOs

Info

ID:	384102
PubChem CID:	134976337
Reduced:	C23H28 (1)
Stoich.:	A23B28 (1)
Weight, g/mol:	220.180329
ΔH_f, kcal/mol:	12.98
Dipole, Da:	1.06
IP(EA), eV:	-9.13(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;2-phenyl-2,3,3a,4,5,6,7,8-octahydro-1H-azulen-8a-ide

Drug info:

PubChemData

Smile

C1CCC(CC1)C2CC(C(C2)C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations