Geometry & MOs

Info

ID:	352998
PubChem CID:	127284119
Reduced:	O3N6C18H22 (1)
Stoich.:	A3B6C18D22 (1)
Weight, g/mol:	395.10704
ΔH_f, kcal/mol:	-9.68
Dipole, Da:	3.8
IP(EA), eV:	-8.85(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-acetylpiperidin-4-yl)-3-(4-chlorobenzoyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CN2CCN(CC2)C(=O)CC3=C(N=C4C=CNN4C3=O)C

DOS

IR

Vibrations