Geometry & MOs

Info

ID:	298207
PubChem CID:	117648041
Reduced:	NH11C16 (3)
Stoich.:	AB11C16 (3)
Weight, g/mol:	580.222472
ΔH_f, kcal/mol:	234.4
Dipole, Da:	0.68
IP(EA), eV:	-7.63(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,7,7-tetramethyl-9-(10-phenylanthracen-9-yl)fluoreno[4,3-b][1]benzothiole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)C6=C2C7=C(N6C8=CC=CC=C8)C=CC(=C7)C9=CC1=CC=CC=C1C=C9

DOS

IR

Vibrations