Geometry & MOs

Info

ID:	283215
PubChem CID:	103964962
Reduced:	ON3C14H15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	255.100777
ΔH_f, kcal/mol:	4.45
Dipole, Da:	2.83
IP(EA), eV:	-8.74(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

15-oxa-8,11,18-triazatetracyclo[8.8.0.02,7.013,17]octadeca-1(10),2,4,6,8-pentaen-12-one

Drug info:

PubChemData

Smile

CCC1C(=O)NC2=C(N1C)C3=CC=CC=C3N=C2

DOS

IR

Vibrations