Geometry & MOs

Info

ID:	430015
PubChem CID:	135170072
Reduced:	FNO2C14H14 (1)
Stoich.:	ABC2D14E14 (1)
Weight, g/mol:	339.11201
ΔH_f, kcal/mol:	-52.64
Dipole, Da:	5.67
IP(EA), eV:	-9.17(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1,3-dihydrobenzimidazol-2-ylidenemethylimino)-1,10-phenanthrolin-5-one

Drug info:

PubChemData

Smile

C1CC(=C(C2=CC(=C(C=C2)C(=O)N3CC3)F)O)C1

DOS

IR

Vibrations