Geometry & MOs

Info

ID:	435948
PubChem CID:	135192940
Reduced:	ON2H16C20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	283.110947
ΔH_f, kcal/mol:	31.19
Dipole, Da:	2.6
IP(EA), eV:	-8.36(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,14,16-triazapentacyclo[13.7.0.02,7.08,13.017,22]docosa-2,4,6,8,10,12,14,17,19,21-decaene

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2N(C1=O)C3=CC=CC=C3C4=CC=CC=C4N

DOS

IR

Vibrations