Geometry & MOs

Info

ID:	32397
PubChem CID:	7768276
Reduced:	NO6H21C23 (1)
Stoich.:	AB6C21D23 (1)
Weight, g/mol:	392.120607
ΔH_f, kcal/mol:	-201.34
Dipole, Da:	5.65
IP(EA), eV:	-9.14(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2-methylphenoxy)ethanone

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=CC=C1NC(=O)COC2=CC3=C(C=C2)C4=C(CCC4)C(=O)O3

DOS

IR

Vibrations