Geometry & MOs

Info

ID:

122567

PubChem CID:

50812726

Reduced:

N2O3C13H14 (2)

Stoich.:

A2B3C13D14 (2)

Weight, g/mol:

494.180149

ΔHf, kcal/mol:

-192.65

Dipole, Da:

4.33

IP(EA), eV:

 -8.52(-1.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

ethyl 3-[[2-(2,3-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-1,7-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2C(=NC(=C1)C)N(C(=O)N(C2=O)CC3=C(OC(=N3)C4=CC=C(C=C4)OC(C)C)C)C

DOS

IR

Vibrations