Geometry & MOs

Info

ID:	366779
PubChem CID:	127320316
Reduced:	SN3O4C16H29 (1)
Stoich.:	AB3C4D16E29 (1)
Weight, g/mol:	341.152161
ΔH_f, kcal/mol:	-178.87
Dipole, Da:	4.78
IP(EA), eV:	-8.99(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-imidazol-5-ylsulfonyl)piperazin-1-yl]-1-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

C1CCCN(CC1)C(=O)CN2CCN(CC2)S(=O)(=O)C3CCOC3

DOS

IR

Vibrations