Geometry & MOs

Info

ID:	158408
PubChem CID:	56463584
Reduced:	SO3N5C23H29 (1)
Stoich.:	AB3C5D23E29 (1)
Weight, g/mol:	437.206304
ΔH_f, kcal/mol:	-41.6
Dipole, Da:	5.34
IP(EA), eV:	-8.55(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-2,4-dioxo-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC(CN1CCN(CC1)C)C2=CC=CC=C2)NC3=NS(=O)(=O)C4=CC=CC=C43

DOS

IR

Vibrations