Geometry & MOs

Info

ID:	326729
PubChem CID:	126688100
Reduced:	NO2H25C35 (1)
Stoich.:	AB2C25D35 (1)
Weight, g/mol:	631.178358
ΔH_f, kcal/mol:	91.71
Dipole, Da:	3.0
IP(EA), eV:	-8.22(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-bis(benzo[b]oxanthren-3-yl)-9H-carbazole

Drug info:

PubChemData

Smile

CC1=C(C2=C(N1C3=CC=CC=C3)C=C(C=C2)C4=CC5=C(C=C4)OC6=CC7=CC=CC=C7C=C6O5)/C=C\C=C

DOS

IR

Vibrations