Geometry & MOs

Info

ID:	275364
PubChem CID:	103815499
Reduced:	ON3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	234.140199
ΔH_f, kcal/mol:	-13.37
Dipole, Da:	2.74
IP(EA), eV:	-8.86(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(2-propan-2-ylsulfonylethyl)piperazine

Drug info:

PubChemData

Smile

CC1CN(CCN1)CC2=NC=C(O2)C

DOS

IR

Vibrations