Geometry & MOs

Info

ID:

439776

PubChem CID:

135229596

Reduced:

S2N4C15H26 (1)

Stoich.:

A2B4C15D26 (1)

Weight, g/mol:

883.34503

ΔHf, kcal/mol:

27.33

Dipole, Da:

3.28

IP(EA), eV:

 -8.43(-0.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)spiro[2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene-13,9'-3,4-dihydrofluorene]-4'-amine

Drug info:

PubChemData

Smile

CSC1CCN(C1)CC(C2CCN(CC2)C3=NC=CS3)N

DOS

IR

Vibrations