Geometry & MOs

Info

ID:	153519
PubChem CID:	56312754
Reduced:	SN3O4C19H31 (1)
Stoich.:	AB3C4D19E31 (1)
Weight, g/mol:	447.199191
ΔH_f, kcal/mol:	-192.01
Dipole, Da:	5.19
IP(EA), eV:	-9.59(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylacetamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CN(C(=O)C=C1)CC(=O)NC2(CCC(CC2)C)C

DOS

IR

Vibrations