Geometry & MOs

Info

ID:	348438
PubChem CID:	127273539
Reduced:	SN3O4C18H31 (1)
Stoich.:	AB3C4D18E31 (1)
Weight, g/mol:	378.172562
ΔH_f, kcal/mol:	-204.75
Dipole, Da:	5.47
IP(EA), eV:	-9.04(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]-(6-pyrrolidin-1-ylpyridin-3-yl)methanone

Drug info:

PubChemData

Smile

CC(CC(=O)N1CCN(CC1)C2CCS(=O)(=O)C2)NC(=O)C3CCCC3

DOS

IR

Vibrations