Geometry & MOs

Info

ID:

379365

PubChem CID:

134419183

Reduced:

NSH41C49 (1)

Stoich.:

ABC41D49 (1)

Weight, g/mol:

651.256215

ΔHf, kcal/mol:

203.23

Dipole, Da:

3.56

IP(EA), eV:

 -6.95(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(3-phenylphenyl)-N-[(Z)-[(2E)-2-prop-2-enylidene-1-benzofuran-3-ylidene]methyl]-9,9'-spirobi[fluorene]-2-amine

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=C(C=C4)S(C)(C)C)C5=CC6=C(C=C5)C7=CC=CC=C7C68C9=CC=CC=C9C1=CC=CC=C81)C

DOS

IR

Vibrations