Geometry & MOs

Info

ID:	364280
PubChem CID:	127315379
Reduced:	SN3O4C19H27 (1)
Stoich.:	AB3C4D19E27 (1)
Weight, g/mol:	358.192629
ΔH_f, kcal/mol:	-173.17
Dipole, Da:	8.59
IP(EA), eV:	-10.03(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-1-[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]butan-1-one

Drug info:

PubChemData

Smile

CC(C1=CN=CC=C1)NC(=O)C2CCCCC2C(=O)NC3CCS(=O)(=O)C3

DOS

IR

Vibrations