Geometry & MOs

Info

ID:	303746
PubChem CID:	124490126
Reduced:	NOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-39.69
Dipole, Da:	2.44
IP(EA), eV:	-8.79(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aR,10aR)-6-methoxy-2-methyl-3,4,10,10a-tetrahydro-1H-chromeno[3,2-c]pyridin-4a-ol

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@@H]1C3=CC=CC=C3CC2)O

DOS

IR

Vibrations