Geometry & MOs

Info

ID:	276837
PubChem CID:	103825431
Reduced:	ON2C5H9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	352.96795
ΔH_f, kcal/mol:	-63.88
Dipole, Da:	3.57
IP(EA), eV:	-10.21(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(4-hydroxybutan-2-yl)-4-iodobenzamide

Drug info:

PubChemData

Smile

CCCC(CCO)CNC(=O)C1=NC=NN1

DOS

IR

Vibrations