Geometry & MOs

Info

ID:	268660
PubChem CID:	103600360
Reduced:	BrINOC17H17 (1)
Stoich.:	ABCDE17F17 (1)
Weight, g/mol:	302.97563
ΔH_f, kcal/mol:	5.87
Dipole, Da:	3.48
IP(EA), eV:	-8.71(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-5-iodo-N-prop-2-enylbenzamide

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Br)I

DOS

IR

Vibrations