Geometry & MOs

Info

ID:	191730
PubChem CID:	78182559
Reduced:	ON3C20H27 (1)
Stoich.:	AB3C20D27 (1)
Weight, g/mol:	251.105862
ΔH_f, kcal/mol:	-24.0
Dipole, Da:	4.65
IP(EA), eV:	-9.27(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14,15,18-triazatetracyclo[9.7.0.02,7.012,17]octadeca-1(11),2,4,6,15,17-hexaen-13-one

Drug info:

PubChemData

Smile

C1CCC2C(C1)CCC3C2NC4C3C(=O)NNC4C5=CC=CC=C5

DOS

IR

Vibrations