Geometry & MOs

Info

ID:	362368
PubChem CID:	127307459
Reduced:	SO2N5C18H29 (1)
Stoich.:	AB2C5D18E29 (1)
Weight, g/mol:	351.161663
ΔH_f, kcal/mol:	-77.0
Dipole, Da:	0.89
IP(EA), eV:	-9.03(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-4-benzyl-2-methylpiperazin-1-yl]-(1,1-dioxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)C(C)NC(=O)N2CCN(CC2)C(=O)CN3CCCC3

DOS

IR

Vibrations