Geometry & MOs

Info

ID:

313118

PubChem CID:

126612074

Reduced:

NOH61C92 (1)

Stoich.:

ABC61D92 (1)

Weight, g/mol:

667.214744

ΔHf, kcal/mol:

318.66

Dipole, Da:

1.0

IP(EA), eV:

-7.59(-0.72)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,8-di(dibenzofuran-4-yl)-10-(4-phenylphenyl)phenoxazine

Drug info:

PubChemData

Smile

CC1(C2=CC3=C(C=C2C4=C1C=C5C6=CC=CC=C6C7(C5=C4)C8=CC=CC=C8C9=CC=CC=C79)N(C1=C(O3)C=C2C(=C1)C1=C(C2(C)C)C=C2C3=CC=CC=C3C3(C2=C1)C1=CC=CC=C1C1=CC=CC=C31)C1=C(C=C(C=C1C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations