Geometry & MOs

Info

ID:	356651
PubChem CID:	127292070
Reduced:	SN3O3C21H25 (1)
Stoich.:	AB3C3D21E25 (1)
Weight, g/mol:	378.208947
ΔH_f, kcal/mol:	-94.71
Dipole, Da:	8.64
IP(EA), eV:	-8.8(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methylpiperidin-4-yl)-2-[1-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]cyclohexyl]acetamide

Drug info:

PubChemData

Smile

CC1(CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)CC4=CC=CS4)C(=O)C1)C

DOS

IR

Vibrations