Geometry & MOs

Info

ID:	449239
PubChem CID:	135297085
Reduced:	NC6H8 (2)
Stoich.:	AB6C8 (2)
Weight, g/mol:	240.220164
ΔH_f, kcal/mol:	41.82
Dipole, Da:	1.47
IP(EA), eV:	-8.94(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,7aR)-4a,7a-dimethyl-4,6-di(propan-2-yl)-2,3,5,7-tetrahydropyrrolo[3,4-b][1,4]oxazine

Drug info:

PubChemData

Smile

C1[C@H]2CN(CC2N1)CC3=CC=CC=C3

DOS

IR

Vibrations