Geometry & MOs

Info

ID:	151889
PubChem CID:	56310713
Reduced:	FN2O3C22H27 (1)
Stoich.:	AB2C3D22E27 (1)
Weight, g/mol:	459.264568
ΔH_f, kcal/mol:	-130.27
Dipole, Da:	5.91
IP(EA), eV:	-8.19(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-cyclopentyl-2-(4-fluoro-N-propan-2-ylanilino)acetamide

Drug info:

PubChemData

Smile

CC(C)N(CC(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)C3=CC=C(C=C3)F

DOS

IR

Vibrations