Geometry & MOs

Info

ID:	246800
PubChem CID:	103065007
Reduced:	SN2C17H24 (1)
Stoich.:	AB2C17D24 (1)
Weight, g/mol:	256.19732
ΔH_f, kcal/mol:	40.61
Dipole, Da:	2.09
IP(EA), eV:	-8.55(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-5-methyl-2-propan-2-yl-1-(thiolan-3-yl)piperazine

Drug info:

PubChemData

Smile

C1CC1C2CN(C(CN2)C3=CC=CC=C3)C4CCSC4

DOS

IR

Vibrations