Geometry & MOs

Info

ID:	419814
PubChem CID:	135109181
Reduced:	OSN5C10H13 (1)
Stoich.:	ABC5D10E13 (1)
Weight, g/mol:	270.103814
ΔH_f, kcal/mol:	43.37
Dipole, Da:	3.22
IP(EA), eV:	-8.55(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-hydroxypiperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CSCCN1CC2=CC(=O)N3C(=N2)N=CN3

DOS

IR

Vibrations