Geometry & MOs

Info

ID:	319151
PubChem CID:	126655182
Reduced:	NO2C9H15 (1)
Stoich.:	AB2C9D15 (1)
Weight, g/mol:	184.10342
ΔH_f, kcal/mol:	-86.13
Dipole, Da:	2.55
IP(EA), eV:	-9.66(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-yl-3a,4,5,6,7,7a-hexahydro-[1,3]thiazolo[4,5-c]pyridine

Drug info:

PubChemData

Smile

CC(C)C1=NC2COCCC2O1

DOS

IR

Vibrations