Geometry & MOs

Info

ID:	361566
PubChem CID:	127303758
Reduced:	SN3O3C18H27 (1)
Stoich.:	AB3C3D18E27 (1)
Weight, g/mol:	395.187878
ΔH_f, kcal/mol:	-129.84
Dipole, Da:	5.7
IP(EA), eV:	-8.84(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-[4-(oxane-3-carbonyl)piperazin-1-yl]ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CN(C1CCOC1)C(=O)CC2(CCCCC2)CC(=O)NC3=NC=CS3

DOS

IR

Vibrations