Geometry & MOs

Info

ID:	220448
PubChem CID:	85195387
Reduced:	O5C10H16 (1)
Stoich.:	A5B10C16 (1)
Weight, g/mol:	144.089878
ΔH_f, kcal/mol:	-220.4
Dipole, Da:	1.69
IP(EA), eV:	-10.06(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,4,4a,6,7,8,8a-octahydro-[1,3]oxazino[6,5-e][1,3]oxazine

Drug info:

PubChemData

Smile

CC(=C)CC(C(C(=O)OC)O)C(=O)OC

DOS

IR

Vibrations