Geometry & MOs

Info

ID:	353373
PubChem CID:	127284749
Reduced:	SN2O3C19H26 (1)
Stoich.:	AB2C3D19E26 (1)
Weight, g/mol:	339.125277
ΔH_f, kcal/mol:	-130.27
Dipole, Da:	9.01
IP(EA), eV:	-8.55(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dioxopyrimidin-1-yl)-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C(=O)CCC2)C(=O)N(CC3CCCO3)C4CCSC4

DOS

IR

Vibrations