Geometry & MOs

Info

ID:	55537
PubChem CID:	17395515
Reduced:	SF2N2O3H10C14 (1)
Stoich.:	AB2C2D3E10F14 (1)
Weight, g/mol:	350.114568
ΔH_f, kcal/mol:	-126.15
Dipole, Da:	6.01
IP(EA), eV:	-9.0(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-chloro-N-methylbenzamide

Drug info:

PubChemData

Smile

C1COC(=CO1)C(=O)NC2=NC(=CS2)C3=C(C=CC(=C3)F)F

DOS

IR

Vibrations