Geometry & MOs

Info

ID:	250434
PubChem CID:	103096553
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	310.03169
ΔH_f, kcal/mol:	-37.11
Dipole, Da:	3.66
IP(EA), eV:	-9.25(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(2-bromo-4-methylphenyl)-1,2,4-oxadiazol-3-yl]butan-1-ol

Drug info:

PubChemData

Smile

CCCC(C1=NOC(=N1)CC2=CC(=C(C=C2)C)C)O

DOS

IR

Vibrations