Geometry & MOs

Info

ID:

426404

PubChem CID:

135143907

Reduced:

ClFO2N3H13C15 (1)

Stoich.:

ABC2D3E13F15 (1)

Weight, g/mol:

1477.537582

ΔHf, kcal/mol:

-13.79

Dipole, Da:

3.92

IP(EA), eV:

-9.96(-1.66)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[4'-[4-(4-carbazol-9-ylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-xanthene]-5-yl]-N-phenyl-N-[4-(4-spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-xanthene]-4'-ylphenyl)phenyl]aniline

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NO1)C2=NN=C(O2)C3=CC(=CC(=C3)Cl)F

DOS

IR

Vibrations