Geometry & MOs

Info

ID:	283563
PubChem CID:	103989116
Reduced:	BrINO2H11C15 (1)
Stoich.:	ABCD2E11F15 (1)
Weight, g/mol:	406.93817
ΔH_f, kcal/mol:	-13.67
Dipole, Da:	1.95
IP(EA), eV:	-8.3(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(cyclopentylmethyl)-5-iodobenzamide

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2)NC(=O)C3=C(C=CC(=C3)I)Br

DOS

IR

Vibrations