Geometry & MOs

Info

ID:	445672
PubChem CID:	135268850
Reduced:	ClSN5O5C19H24 (1)
Stoich.:	ABC5D5E19F24 (1)
Weight, g/mol:	419.161184
ΔH_f, kcal/mol:	-146.28
Dipole, Da:	4.53
IP(EA), eV:	-9.47(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-chlorophenyl)methyl]-7-ethoxy-1-ethyl-3-(3-hydroxypropyl)-5,6-dihydropyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)S(=O)(=O)C1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)N(C(=O)N2C)CCCON

DOS

IR

Vibrations