Geometry & MOs

Info

ID:	356389
PubChem CID:	127291462
Reduced:	SN2O4C19H26 (1)
Stoich.:	AB2C4D19E26 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-148.69
Dipole, Da:	3.24
IP(EA), eV:	-8.71(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)C(=O)N1CSCC1C(=O)N(C)CC2COC3=CC=CC=C3O2

DOS

IR

Vibrations