Geometry & MOs

Info

ID:	205173
PubChem CID:	80063978
Reduced:	OCl2N3H9C11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	278.13789
ΔH_f, kcal/mol:	15.62
Dipole, Da:	0.69
IP(EA), eV:	-9.24(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-3-[3-[(6-methoxypyridin-3-yl)methyl]-1,2,4-oxadiazol-5-yl]-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

COC1=NC=C(C=C1)CC2=NC(=CC(=N2)Cl)Cl

DOS

IR

Vibrations