Geometry & MOs

Info

ID:	309094
PubChem CID:	126536743
Reduced:	N3H29C39 (1)
Stoich.:	A3B29C39 (1)
Weight, g/mol:	596.225249
ΔH_f, kcal/mol:	166.56
Dipole, Da:	2.97
IP(EA), eV:	-8.66(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-phenylphenyl)-2-(9,9'-spirobi[fluorene]-4'-yl)-1,8-naphthyridine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C2=NC(=NC3=CC=CC=C32)C4=C5C6=CC=CC=C6C(C5=CC=C4)(C)C)C7=NC=CC8=CC=CC=C87

DOS

IR

Vibrations