Geometry & MOs

Info

ID:	280095
PubChem CID:	103846815
Reduced:	BrClNOH5C9 (1)
Stoich.:	ABCDE5F9 (1)
Weight, g/mol:	273.083493
ΔH_f, kcal/mol:	39.99
Dipole, Da:	6.05
IP(EA), eV:	-9.21(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-methoxy-N-(2-methylsulfinylpropyl)benzamide

Drug info:

PubChemData

Smile

C#CC(=O)NC1=CC(=C(C=C1)Br)Cl

DOS

IR

Vibrations