Geometry & MOs

Info

ID:	280973
PubChem CID:	103852269
Reduced:	BrNO3C10H12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	364.97466
ΔH_f, kcal/mol:	-101.32
Dipole, Da:	5.77
IP(EA), eV:	-9.94(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-iodo-N-methyl-N-(thiolan-3-yl)benzamide

Drug info:

PubChemData

Smile

COCCCOC(=O)C1=C(N=CC=C1)Br

DOS

IR

Vibrations