Geometry & MOs

Info

ID:	431398
PubChem CID:	135171473
Reduced:	O2N3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	225.030504
ΔH_f, kcal/mol:	-35.02
Dipole, Da:	5.14
IP(EA), eV:	-8.74(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-6-ethyl-1H-pyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1CNCCC1OC2=CC=CC=C2C3=CC(=CN=C3)OC4CCNCC4

DOS

IR

Vibrations