Geometry & MOs

Info

ID:	148556
PubChem CID:	53788223
Reduced:	C2H2N3 (2)
Stoich.:	A2B2C3 (2)
Weight, g/mol:	195.068414
ΔH_f, kcal/mol:	136.3
Dipole, Da:	4.1
IP(EA), eV:	-10.36(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-azatricyclo[7.4.1.05,14]tetradeca-1(14),2,5,7,9,12-hexaen-4-one

Drug info:

PubChemData

Smile

C1=C(NN=C1)N2C=NN=N2

DOS

IR

Vibrations