Geometry & MOs

Info

ID:	166868
PubChem CID:	74746204
Reduced:	N3O5C26H29 (1)
Stoich.:	A3B5C26D29 (1)
Weight, g/mol:	369.159651
ΔH_f, kcal/mol:	-144.5
Dipole, Da:	5.54
IP(EA), eV:	-8.82(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

ethyl 1-[2-[2-[2-(4-methyl-1,3-thiazol-2-yl)acetyl]hydrazinyl]-2-oxoethyl]piperidin-1-ium-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NCCCN4CCOCC4

DOS

IR

Vibrations