Geometry & MOs

Info

ID:	27697
PubChem CID:	823141
Reduced:	O4N5C12H15 (1)
Stoich.:	A4B5C12D15 (1)
Weight, g/mol:	307.128054
ΔH_f, kcal/mol:	-124.37
Dipole, Da:	12.65
IP(EA), eV:	-9.72(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(1,3-dimethyl-2,4,5-trioxo-8H-pyrido[2,3-d]pyrimidin-7-yl)butanehydrazide

Drug info:

PubChemData

Smile

CCC(=O)NNC1=CC(=O)C2=C(N1)N(C(=O)N(C2=O)C)C

DOS

IR

Vibrations