Geometry & MOs

Info

ID:	172118
PubChem CID:	75468744
Reduced:	ClO2N7H12C18 (1)
Stoich.:	AB2C7D12E18 (1)
Weight, g/mol:	344.060863
ΔH_f, kcal/mol:	84.39
Dipole, Da:	9.43
IP(EA), eV:	-9.46(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[2-fluoro-5-(furan-2-yl)phenyl]-2-nitrobenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NC2=NC=C(C=C2)Cl)NC(=O)C3=CN4C(=NN=N4)C=C3

DOS

IR

Vibrations