Geometry & MOs

Info

ID:

313138

PubChem CID:

126612171

Reduced:

NOC130H133 (1)

Stoich.:

ABC130D133 (1)

Weight, g/mol:

871.308644

ΔHf, kcal/mol:

153.96

Dipole, Da:

2.24

IP(EA), eV:

 -7.73(-0.72)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,8-bis(1-benzofuran-2-yl)-10-[4-phenyl-2,6-bis(4-phenylphenyl)phenyl]phenoxazine

Drug info:

PubChemData

Smile

CCCCCCCCC1(C2=CC=CC=C2C3=C1C=C(C=C3)C4=CC5=C(C=C4)C6=C(C5(C)C)C=C(C=C6)C7=CC8=C(C=C7)OC9=C(N8C1=C(C=CC=C1C1=CC=C(C=C1)C1=CC=CC=C1)C1=CC=C(C=C1)C1=CC=CC=C1)C=C(C=C9)C1=CC2=C(C=C1)C1=C(C2(C)C)C=C(C=C1)C1=CC2=C(C=C1)C1=CC=CC=C1C2(CCCCCCCC)CCCCCCCC)CCCCCCCC

DOS

IR

Vibrations