Geometry & MOs

Info

ID:	206635
PubChem CID:	80276846
Reduced:	BrFNOC11H13 (1)
Stoich.:	ABCDE11F13 (1)
Weight, g/mol:	215.05132
ΔH_f, kcal/mol:	-85.36
Dipole, Da:	5.14
IP(EA), eV:	-9.92(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloroethyl)-2-fluoro-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NCCCBr)F

DOS

IR

Vibrations