Geometry & MOs

Info

ID:	342075
PubChem CID:	127264788
Reduced:	FN2O2C16H21 (1)
Stoich.:	AB2C2D16E21 (1)
Weight, g/mol:	334.171499
ΔH_f, kcal/mol:	-95.02
Dipole, Da:	1.88
IP(EA), eV:	-8.94(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(2-methyl-3-phenylprop-2-enyl)piperazin-1-yl]thiolane 1,1-dioxide

Drug info:

PubChemData

Smile

CN(CC=CC1=CC=C(C=C1)F)CC(=O)N2CCOCC2

DOS

IR

Vibrations