Geometry & MOs

Info

ID:	445660
PubChem CID:	135268781
Reduced:	Cl2O3N5C21H23 (1)
Stoich.:	A2B3C5D21E23 (1)
Weight, g/mol:	429.206385
ΔH_f, kcal/mol:	-56.81
Dipole, Da:	5.78
IP(EA), eV:	-8.77(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C1=CN(C(=N1)C2=CC=CC=C2Cl)CC3C=CC(=CN3)Cl)C(=O)N(CCCO)C=O

DOS

IR

Vibrations