Geometry & MOs

Info

ID:	325399
PubChem CID:	126683069
Reduced:	N2O3C18H20 (1)
Stoich.:	A2B3C18D20 (1)
Weight, g/mol:	380.148455
ΔH_f, kcal/mol:	-37.39
Dipole, Da:	2.65
IP(EA), eV:	-5.97(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-N-methyl-2-N-(2-methylbutyl)-5,6-dioxo-1,10-phenanthroline-2,9-dicarboxamide

Drug info:

PubChemData

Smile

CCC(C[N+]1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C[N+](=C3)C)OC

DOS

IR

Vibrations