Geometry & MOs

Info

ID:	336392
PubChem CID:	127255399
Reduced:	BN2O4C10H11 (1)
Stoich.:	AB2C4D10E11 (1)
Weight, g/mol:	752.50695
ΔH_f, kcal/mol:	-202.68
Dipole, Da:	9.69
IP(EA), eV:	-10.13(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2-methylphenyl)-7-N-(3-methylphenyl)-9,9-dioctyl-2-N,7-N-diphenylfluorene-2,7-diamine

Drug info:

PubChemData

Smile

[B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C3=CC=NC=C3

DOS

IR

Vibrations