Geometry & MOs

Info

ID:	349009
PubChem CID:	127274735
Reduced:	ON4C20H24 (1)
Stoich.:	AB4C20D24 (1)
Weight, g/mol:	395.224263
ΔH_f, kcal/mol:	17.96
Dipole, Da:	7.73
IP(EA), eV:	-9.48(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(3-methylpiperidine-1-carbonyl)piperidine-1-carbonyl]-1,3-thiazolidin-3-yl]butan-1-one

Drug info:

PubChemData

Smile

CN(C1C2CC3CC(C2)CC1C3)C(=O)C4=CC=C(C=C4)N5C=NN=C5

DOS

IR

Vibrations