Geometry & MOs

Info

ID:

378643

PubChem CID:

134224737

Reduced:

OS2Br3N4H57C95 (1)

Stoich.:

AB2C3D4E57F95 (1)

Weight, g/mol:

549.10921

ΔHf, kcal/mol:

402.78

Dipole, Da:

3.52

IP(EA), eV:

 -7.78(-1.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-bromo-9-(naphthalen-1-ylmethylidene)-N,N-diphenylfluoren-2-amine

Drug info:

PubChemData

Smile

C1C2=C(C=C(C=C2)N(C3=CC=CC=C3)C4=CC5=C(C=C4)N(C=C5)C6=CC=CC(=C6)C7=CC=C(C8=CC=CC=C87)N(C9=CC2=C(C=C9)C3=C(S2)C=C(C=C3)Br)C2=CC=CC(=C2)C2=CC=CC3=C2C=CC(=C3)N(C2=CC3=C(C=C2)SC2=CC=CC=C23)C2=CC3=C(C=C2)C2=C(O3)C=C(C=C2)Br)C2=C1C=C(C=C2)Br

DOS

IR

Vibrations