Geometry & MOs

Info

ID:

446286

PubChem CID:

135273805

Reduced:

NH19C25 (1)

Stoich.:

AB19C25 (1)

Weight, g/mol:

688.262697

ΔHf, kcal/mol:

80.85

Dipole, Da:

1.63

IP(EA), eV:

 -8.23(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

11-(4,6-diphenyl-1,3,5-triazin-2-yl)-15,15-diphenyl-11-azahexacyclo[14.7.1.02,14.04,12.05,10.020,24]tetracosa-1(23),2(14),3,5,7,9,12,16,18,20(24),21-undecaene

Drug info:

PubChemData

Smile

CC1(C2=CC=CC3=C2C(=CC=C3)C4=C1C5=C(C=C4)C6=CC=CC=C6N5)C

DOS

IR

Vibrations