Geometry & MOs

Info

ID:	249361
PubChem CID:	103088929
Reduced:	SN3C10H25 (1)
Stoich.:	AB3C10D25 (1)
Weight, g/mol:	326.005882
ΔH_f, kcal/mol:	-12.5
Dipole, Da:	2.99
IP(EA), eV:	-8.4(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dichloro-3-fluorophenyl)sulfonyl-2-methylpiperazine

Drug info:

PubChemData

Smile

CN(C)CCNC(CCCSC)CN

DOS

IR

Vibrations