Geometry & MOs

Info

ID:	238014
PubChem CID:	92728804
Reduced:	S2N3O5C20H29 (1)
Stoich.:	A2B3C5D20E29 (1)
Weight, g/mol:	363.136511
ΔH_f, kcal/mol:	-208.52
Dipole, Da:	5.1
IP(EA), eV:	-9.3(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)SCC(=O)OCC(=O)N([C@H]2CCS(=O)(=O)C2)C3CCCCC3)C

DOS

IR

Vibrations