Geometry & MOs

Info

ID:	349896
PubChem CID:	127276701
Reduced:	SN3O4C18H29 (1)
Stoich.:	AB3C4D18E29 (1)
Weight, g/mol:	321.114713
ΔH_f, kcal/mol:	-203.26
Dipole, Da:	7.76
IP(EA), eV:	-9.93(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxo-1,4-thiazinan-4-yl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Drug info:

PubChemData

Smile

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)N4CCS(=O)(=O)CC4

DOS

IR

Vibrations