Geometry & MOs

Info

ID:	445742
PubChem CID:	135269286
Reduced:	N2F3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	434.195405
ΔH_f, kcal/mol:	-171.0
Dipole, Da:	3.36
IP(EA), eV:	-8.24(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(4-aminophenoxy)-6-benzyl-3-(3-hydroxypropyl)-1-methyl-5,6-dihydropyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C/C(=C(/CCCCC(F)(F)F)\C(=C)NC)/NC

DOS

IR

Vibrations