Geometry & MOs

Info

ID:	449096
PubChem CID:	135295966
Reduced:	NC12H15 (1)
Stoich.:	AB12C15 (1)
Weight, g/mol:	207.125929
ΔH_f, kcal/mol:	45.94
Dipole, Da:	2.49
IP(EA), eV:	-9.54(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-tert-butylpyridin-2-yl)oxypropan-2-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=CN=C(C=C1)CC#C

DOS

IR

Vibrations