Geometry & MOs

Info

ID:	370685
PubChem CID:	127339874
Reduced:	ON5C17H19 (1)
Stoich.:	AB5C17D19 (1)
Weight, g/mol:	368.159689
ΔH_f, kcal/mol:	50.29
Dipole, Da:	6.18
IP(EA), eV:	-9.19(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-6-[4-(2-methylpyrazol-3-yl)piperidine-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C(=CC=N1)C2CCN(CC2)C(=O)C3=CC=CC4=C3NN=C4

DOS

IR

Vibrations