Geometry & MOs

Info

ID:	413699
PubChem CID:	135086648
Reduced:	SiN2O2C12H25 (1)
Stoich.:	AB2C2D12E25 (1)
Weight, g/mol:	209.068808
ΔH_f, kcal/mol:	-92.6
Dipole, Da:	2.5
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.799646
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(5-methoxypyridin-2-yl)-2-oxopropanoate

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)/C(=C(\O)/OC(C)(C)C)/[N+]#N

DOS

IR

Vibrations