Geometry & MOs

Info

ID:	268617
PubChem CID:	103600225
Reduced:	BrINOC17H17 (1)
Stoich.:	ABCDE17F17 (1)
Weight, g/mol:	275.095771
ΔH_f, kcal/mol:	1.25
Dipole, Da:	3.95
IP(EA), eV:	-9.09(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-fluorophenyl)ethyl]-2,4-dihydroxybenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(C)NC(=O)C2=C(C=CC(=C2)Br)I

DOS

IR

Vibrations