Geometry & MOs

Info

ID:	168230
PubChem CID:	74938589
Reduced:	O2N4C15H16 (1)
Stoich.:	A2B4C15D16 (1)
Weight, g/mol:	458.970615
ΔH_f, kcal/mol:	-26.55
Dipole, Da:	3.0
IP(EA), eV:	-8.77(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1-(4-chlorophenyl)-5-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]-2,6-dioxopyrimidin-4-olate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2NC(NC(=O)N2)O)C3=CC=CC=C3

DOS

IR

Vibrations