Geometry & MOs

Info

ID:	268616
PubChem CID:	103600224
Reduced:	FINO2H13C15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	456.95382
ΔH_f, kcal/mol:	-81.97
Dipole, Da:	3.81
IP(EA), eV:	-9.14(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[1-(2,5-dimethylphenyl)ethyl]-2-iodobenzamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1F)NC(=O)C2=C(C=CC(=C2)I)O

DOS

IR

Vibrations