Geometry & MOs

Info

ID:	287353
PubChem CID:	104238656
Reduced:	ClO4C12H15 (1)
Stoich.:	AB4C12D15 (1)
Weight, g/mol:	282.07712
ΔH_f, kcal/mol:	-164.69
Dipole, Da:	2.76
IP(EA), eV:	-9.09(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[3-chloro-4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanol

Drug info:

PubChemData

Smile

CCOC(=O)COC1=C(C=C(C=C1)[C@@H](C)O)Cl

DOS

IR

Vibrations