Geometry & MOs

Info

ID:	69831
PubChem CID:	47205486
Reduced:	ON5C13H15 (1)
Stoich.:	AB5C13D15 (1)
Weight, g/mol:	316.064841
ΔH_f, kcal/mol:	22.36
Dipole, Da:	2.47
IP(EA), eV:	-9.22(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methylphenyl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)NC(=O)CCNC2=NC=CC=N2

DOS

IR

Vibrations