Geometry & MOs

Info

ID:	356380
PubChem CID:	127291453
Reduced:	SO2N5C16H23 (1)
Stoich.:	AB2C5D16E23 (1)
Weight, g/mol:	362.177647
ΔH_f, kcal/mol:	-29.99
Dipole, Da:	2.65
IP(EA), eV:	-9.04(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclobutyl-[4-[3-(4-methylpyrazol-1-yl)piperidine-1-carbonyl]-1,3-thiazolidin-3-yl]methanone

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CSCC2C(=O)N3CCCC(C3)N4C=NC=N4

DOS

IR

Vibrations