Geometry & MOs

Info

ID:	150149
PubChem CID:	53789836
Reduced:	O3N4C14H18 (1)
Stoich.:	A3B4C14D18 (1)
Weight, g/mol:	193.073893
ΔH_f, kcal/mol:	-82.71
Dipole, Da:	4.68
IP(EA), eV:	-9.07(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(2-methylpyridin-3-yl)-3-oxopropanoate

Drug info:

PubChemData

Smile

CC(=O)CCCN1C=NC2=C1C(=O)N(C(=O)N2C3CC3)C

DOS

IR

Vibrations