Geometry & MOs

Info

ID:	68597
PubChem CID:	46508729
Reduced:	FSN2O3H17C19 (1)
Stoich.:	ABC2D3E17F19 (1)
Weight, g/mol:	463.259483
ΔH_f, kcal/mol:	-81.2
Dipole, Da:	6.52
IP(EA), eV:	-8.78(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-(2-methoxyethyl)amino]-N-[1-(4-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)F)OC3=CC=C(C=C3)OC

DOS

IR

Vibrations