Geometry & MOs

Info

ID:	325344
PubChem CID:	126682843
Reduced:	N2H14C21 (1)
Stoich.:	A2B14C21 (1)
Weight, g/mol:	294.115698
ΔH_f, kcal/mol:	92.24
Dipole, Da:	4.16
IP(EA), eV:	-8.19(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

15-phenyl-6,8-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=NC=CC4=C3C(=C2)C5=CC=CC=C5N4

DOS

IR

Vibrations