Geometry & MOs

Info

ID:	181231
PubChem CID:	76719060
Reduced:	N2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	295.132077
ΔH_f, kcal/mol:	-59.69
Dipole, Da:	2.97
IP(EA), eV:	-10.36(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-2-methyl-7-phenylmethoxy-4aH-pyrido[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CCC1=NC(=O)C2C(=CC(=O)OC2=N1)CCC3CC3

DOS

IR

Vibrations