Geometry & MOs

Info

ID:	374924
PubChem CID:	131407110
Reduced:	N3O3C10H13 (1)
Stoich.:	A3B3C10D13 (1)
Weight, g/mol:	223.095691
ΔH_f, kcal/mol:	-99.13
Dipole, Da:	2.2
IP(EA), eV:	-8.51(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-oxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-8-carboxylic acid

Drug info:

PubChemData

Smile

CCC1C(=O)N(C(=O)N1)C2=C(C=C(O2)N)C

DOS

IR

Vibrations