Geometry & MOs

Info

ID:	24264
PubChem CID:	608873
Reduced:	H5C8 (2)
Stoich.:	A5B8 (2)
Weight, g/mol:	202.07825
ΔH_f, kcal/mol:	61.5
Dipole, Da:	0.01
IP(EA), eV:	-8.35(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	-6

Chem-info

IUPAC name:

2,3,4,5-tetrahydro-1H-pyrene-1,2,3,3a,4,5-hexaide

Drug info:

PubChemData

Smile

[CH-]1[CH-][C-]2[CH-][CH-]C3=C4C2=C([CH-]1)C=CC4=CC=C3

DOS

IR

Vibrations