Geometry & MOs

Info

ID:	279607
PubChem CID:	103844451
Reduced:	BrNOC10H12 (1)
Stoich.:	ABCD10E12 (1)
Weight, g/mol:	262.131742
ΔH_f, kcal/mol:	-11.15
Dipole, Da:	5.4
IP(EA), eV:	-9.15(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C1)COC2=CN=C(C=C2)Br

DOS

IR

Vibrations