Geometry & MOs

Info

ID:	180924
PubChem CID:	76705415
Reduced:	O4C7H10 (1)
Stoich.:	A4B7C10 (1)
Weight, g/mol:	223.084458
ΔH_f, kcal/mol:	-173.45
Dipole, Da:	6.3
IP(EA), eV:	-10.75(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-methoxy-2-(2-methyl-6-oxopyridin-1-yl)prop-2-enoate

Drug info:

PubChemData

Smile

C1CC2(CC(C1O)OC2=O)O

DOS

IR

Vibrations