Geometry & MOs

Info

ID:

316360

PubChem CID:

126630800

Reduced:

NH10C14 (6)

Stoich.:

AB10C14 (6)

Weight, g/mol:

1152.487946

ΔHf, kcal/mol:

348.15

Dipole, Da:

1.19

IP(EA), eV:

 -8.08(-1.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole

Drug info:

PubChemData

Smile

CC1(C2=C(C3=CC=CC=C31)C4=C(C=C2)N(C5=CC=CC=C54)C6=CC=C(C=C6)C7=NC(=NC(=N7)C8=CC(=CC=C8)N9C1=C(C2=CC=CC=C29)C2=C(C=C1)C(C1=CC=CC=C12)(C)C)C1=CC=C(C=C1)N1C2=C(C3=CC=CC=C31)C1=C(C=C2)C(C2=CC=CC=C21)(C)C)C

DOS

IR

Vibrations