Geometry & MOs

Info

ID:	439596
PubChem CID:	135229372
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	295.171834
ΔH_f, kcal/mol:	-13.21
Dipole, Da:	2.83
IP(EA), eV:	-8.47(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylpyrrolidin-1-yl)-1-[1-(1,3-thiazol-2-yl)piperidin-4-yl]ethanol

Drug info:

PubChemData

Smile

COC1CCN(C1)CC(=O)C2CCN(CC2)C3=NC=C(C=C3)C4=NC=CC=N4

DOS

IR

Vibrations