Geometry & MOs

Info

ID:	365675
PubChem CID:	127318396
Reduced:	O2N5C16H19 (1)
Stoich.:	A2B5C16D19 (1)
Weight, g/mol:	329.112404
ΔH_f, kcal/mol:	27.09
Dipole, Da:	1.47
IP(EA), eV:	-9.11(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-6-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=NN(C2=N1)C)C)C3=NC(=NO3)C4CCOCC4

DOS

IR

Vibrations