Geometry & MOs

Info

ID:	263237
PubChem CID:	103348536
Reduced:	N2O5C12H14 (1)
Stoich.:	A2B5C12D14 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-168.71
Dipole, Da:	1.64
IP(EA), eV:	-9.65(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-(6-methoxypyridin-2-yl)-3-methylbut-3-en-2-one

Drug info:

PubChemData

Smile

CN1C(C(OCC1=O)C(=O)O)C2=NC(=CC=C2)OC

DOS

IR

Vibrations