Geometry & MOs

Info

ID:	343762
PubChem CID:	127266938
Reduced:	ON4C19H26 (1)
Stoich.:	AB4C19D26 (1)
Weight, g/mol:	339.198048
ΔH_f, kcal/mol:	-5.64
Dipole, Da:	4.87
IP(EA), eV:	-8.71(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[4-hydroxy-4-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]propanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(C)N1CCC(C1)C2=NC3=C(C=CC=N3)C=C2

DOS

IR

Vibrations