Geometry & MOs

Info

ID:	346647
PubChem CID:	127271151
Reduced:	ON3C9H13 (2)
Stoich.:	AB3C9D13 (2)
Weight, g/mol:	331.102434
ΔH_f, kcal/mol:	-19.61
Dipole, Da:	8.93
IP(EA), eV:	-9.16(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxo-1,4-thiazinan-4-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)C2CCN(CC2)C3=NN4C=NN=C4C=C3

DOS

IR

Vibrations