Geometry & MOs

Info

ID:	197259
PubChem CID:	78944613
Reduced:	O2Cl3H13C15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	359.93195
ΔH_f, kcal/mol:	-72.86
Dipole, Da:	2.09
IP(EA), eV:	-9.14(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[3-bromo-4-(2,3-dichlorophenoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

C[C@@H](C1=C(C=CC(=C1)Cl)OCC2=CC(=C(C=C2)Cl)Cl)O

DOS

IR

Vibrations