Geometry & MOs

Info

ID:	407884
PubChem CID:	135080639
Reduced:	BrNOC10H10 (1)
Stoich.:	ABCD10E10 (1)
Weight, g/mol:	275.96473
ΔH_f, kcal/mol:	-1.66
Dipole, Da:	4.8
IP(EA), eV:	-9.94(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-hydroxy-1-(2-iodophenyl)propan-2-one

Drug info:

PubChemData

Smile

C[C@@](CC1=CC(=CC=C1)Br)(C#N)O

DOS

IR

Vibrations