Geometry & MOs

Info

ID:	383966
PubChem CID:	134976083
Reduced:	NOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	231.125929
ΔH_f, kcal/mol:	-10.04
Dipole, Da:	0.44
IP(EA), eV:	-8.72(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,8aS)-8a-methyl-1-phenyl-5,6,7,8-tetrahydro-1H-[1,3]oxazolo[3,4-a]pyridin-3-one

Drug info:

PubChemData

Smile

C=CCN1CCC[C@H]1C(C2=CC=CC=C2)O

DOS

IR

Vibrations