Geometry & MOs

Info

ID:	205360
PubChem CID:	80091687
Reduced:	N2O3C12H12 (1)
Stoich.:	A2B3C12D12 (1)
Weight, g/mol:	261.074956
ΔH_f, kcal/mol:	-69.33
Dipole, Da:	6.32
IP(EA), eV:	-8.89(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dimethylpyridin-3-yl)-2,4-dioxopyrimidine-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)NC2=CC=C(O2)C(=O)O)C

DOS

IR

Vibrations