Geometry & MOs

Info

ID:	268564
PubChem CID:	103600024
Reduced:	BrNO2C15H18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	446.9131
ΔH_f, kcal/mol:	-76.96
Dipole, Da:	3.01
IP(EA), eV:	-9.26(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[(2-fluorophenyl)methyl]-2-iodo-N-methylbenzamide

Drug info:

PubChemData

Smile

C1CCC(=CC1)CCNC(=O)C2=C(C=CC(=C2)Br)O

DOS

IR

Vibrations