Geometry & MOs

Info

ID:

298146

PubChem CID:

117647735

Reduced:

N2F3O3C20H21 (1)

Stoich.:

A2B3C3D20E21 (1)

Weight, g/mol:

949.439599

ΔHf, kcal/mol:

-234.91

Dipole, Da:

7.18

IP(EA), eV:

 -9.6(-0.87)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-N,17-N-bis(2,4-diphenylphenyl)-10,10,20,20-tetramethyl-7-N,17-N-diphenyl-2-azapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaene-7,17-diamine

Drug info:

PubChemData

Smile

C1COCC1CNC(=O)C2=NC=C(C=C2)COCC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations