Geometry & MOs

Info

ID:	280366
PubChem CID:	103848659
Reduced:	NF3O3C12H12 (1)
Stoich.:	AB3C3D12E12 (1)
Weight, g/mol:	284.08085
ΔH_f, kcal/mol:	-253.14
Dipole, Da:	2.56
IP(EA), eV:	-10.01(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-N-[(3-hydroxyoxolan-3-yl)methyl]-2-nitrobenzamide

Drug info:

PubChemData

Smile

C1COCC1(CNC(=O)C2=C(C=C(C=C2F)F)F)O

DOS

IR

Vibrations