Geometry & MOs

Info

ID:	370828
PubChem CID:	127340964
Reduced:	NSO2C11H23 (1)
Stoich.:	ABC2D11E23 (1)
Weight, g/mol:	371.133734
ΔH_f, kcal/mol:	-117.85
Dipole, Da:	6.57
IP(EA), eV:	-9.26(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1CN(CCS1(=O)=O)CCC(C)(C)C

DOS

IR

Vibrations