Geometry & MOs

Info

ID:	356311
PubChem CID:	127291384
Reduced:	SO3N5C18H29 (1)
Stoich.:	AB3C5D18E29 (1)
Weight, g/mol:	379.167811
ΔH_f, kcal/mol:	-81.28
Dipole, Da:	1.32
IP(EA), eV:	-9.32(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclobutyl-[4-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazine-1-carbonyl]-1,3-thiazolidin-3-yl]methanone

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)C3CSCN3C(=O)CC(C)(C)C

DOS

IR

Vibrations