Geometry & MOs

Info

ID:	207727
PubChem CID:	80443667
Reduced:	N2C13H28 (1)
Stoich.:	A2B13C28 (1)
Weight, g/mol:	254.235814
ΔH_f, kcal/mol:	-12.9
Dipole, Da:	0.97
IP(EA), eV:	-8.59(2.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-N-ethyl-3-methylbutan-2-amine

Drug info:

PubChemData

Smile

CCCCN(CC(C(C)C)NC)C1CC1

DOS

IR

Vibrations