Geometry & MOs

Info

ID:	359432
PubChem CID:	127298569
Reduced:	OSN5C13H19 (1)
Stoich.:	ABC5D13E19 (1)
Weight, g/mol:	372.128983
ΔH_f, kcal/mol:	49.35
Dipole, Da:	4.17
IP(EA), eV:	-8.94(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothiolan-3-yl)-2-[4-[(4-methyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)CN2CCN(CC2)CC3=NC(=NO3)C

DOS

IR

Vibrations