Geometry & MOs

Info

ID:	371536
PubChem CID:	127346874
Reduced:	NO2S2C11H19 (1)
Stoich.:	AB2C2D11E19 (1)
Weight, g/mol:	243.1293
ΔH_f, kcal/mol:	-90.31
Dipole, Da:	2.49
IP(EA), eV:	-8.55(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylcyclopentyl)-(2-methyl-1-oxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCS1=O)C(=O)C2CCSCC2

DOS

IR

Vibrations