Geometry & MOs

Info

ID:	429577
PubChem CID:	135169626
Reduced:	NC2H3 (4)
Stoich.:	AB2C3 (4)
Weight, g/mol:	731.232125
ΔH_f, kcal/mol:	51.56
Dipole, Da:	0.77
IP(EA), eV:	-8.01(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-7-phenyl-8-oxa-6,11-diazapentacyclo[10.8.0.02,10.05,9.013,18]icosa-1(12),2(10),3,5(9),6,13,15,17,19-nonaene

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)/C(=C\N)/NN)N

DOS

IR

Vibrations