Geometry & MOs

Info

ID:	358614
PubChem CID:	127296373
Reduced:	NS2O6C15H19 (1)
Stoich.:	AB2C6D15E19 (1)
Weight, g/mol:	254.108899
ΔH_f, kcal/mol:	-203.01
Dipole, Da:	7.35
IP(EA), eV:	-8.63(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-oxo-1,4-thiazinan-4-yl)-(1,2,5-trimethylpyrrol-3-yl)methanone

Drug info:

PubChemData

Smile

C1CS(=O)CCN1C(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations