Geometry & MOs

Info

ID:	216159
PubChem CID:	85085814
Reduced:	N2O4C11H12 (1)
Stoich.:	A2B4C11D12 (1)
Weight, g/mol:	236.058578
ΔH_f, kcal/mol:	-118.78
Dipole, Da:	5.22
IP(EA), eV:	-10.24(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),4,6,9,11,13-hexaene-3,8-dione

Drug info:

PubChemData

Smile

CCNC(=O)C=CC1=NC(=O)C(C=C1)C(=O)O

DOS

IR

Vibrations