Geometry & MOs

Info

ID:	445489
PubChem CID:	135267376
Reduced:	NS2O3C20H31 (1)
Stoich.:	AB2C3D20E31 (1)
Weight, g/mol:	270.078662
ΔH_f, kcal/mol:	-131.54
Dipole, Da:	3.87
IP(EA), eV:	-8.74(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)pyrimidin-5-yl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C(C)C)C(=O)C(C)N(C)C(=O)C(C)SC(C1=CC=C(C=C1)OC)S

DOS

IR

Vibrations