Geometry & MOs

Info

ID:	372312
PubChem CID:	131296114
Reduced:	FON2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	202.074228
ΔH_f, kcal/mol:	-40.55
Dipole, Da:	3.79
IP(EA), eV:	-9.04(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methyl-4-pyridin-3-yl-1,2-oxazol-5-yl)ethanone

Drug info:

PubChemData

Smile

C1CCNC(C1)C2=C(C=CC(=C2O)F)C#N

DOS

IR

Vibrations