Geometry & MOs

Info

ID:	285626
PubChem CID:	104115265
Reduced:	NOC6H10 (2)
Stoich.:	ABC6D10 (2)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	-71.9
Dipole, Da:	4.62
IP(EA), eV:	-8.77(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1,3-oxazol-4-yl]methanol

Drug info:

PubChemData

Smile

CN(C1CCCCCC1)C2=NC(=CO2)CO

DOS

IR

Vibrations