Geometry & MOs

Info

ID:

329027

PubChem CID:

126730643

Reduced:

NH11C14 (4)

Stoich.:

AB11C14 (4)

Weight, g/mol:

758.340947

ΔHf, kcal/mol:

219.84

Dipole, Da:

2.27

IP(EA), eV:

 -7.82(-0.72)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-[4-[4-[2,6-bis(2-methylphenyl)pyrimidin-4-yl]phenyl]-2-methylphenyl]-N,N-diphenylcarbazol-3-amine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=CC(=NC(=N2)C3=CC=CC=C3C)C4=CC(=C(C(=C4)C)C5=CC=C(C=C5)N6C7=C(C=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9)C1=CC=CC=C16)C

DOS

IR

Vibrations