Geometry & MOs

Info

ID:	56485
PubChem CID:	17435879
Reduced:	FOSN6H11C15 (1)
Stoich.:	ABCD6E11F15 (1)
Weight, g/mol:	378.172562
ΔH_f, kcal/mol:	66.13
Dipole, Da:	6.42
IP(EA), eV:	-9.54(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-3-thiophen-3-ylpropanamide

Drug info:

PubChemData

Smile

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)CN3C=NN=C3C#N

DOS

IR

Vibrations