Geometry & MOs

Info

ID:	325345
PubChem CID:	126682844
Reduced:	N2H14C21 (1)
Stoich.:	A2B14C21 (1)
Weight, g/mol:	294.115698
ΔH_f, kcal/mol:	92.49
Dipole, Da:	1.17
IP(EA), eV:	-7.99(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

15-phenyl-4,8-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=C4C(=C2)C=CC=C4NC5=C3C=CC=N5

DOS

IR

Vibrations