Geometry & MOs

Info

ID:	19746
PubChem CID:	571843
Reduced:	NOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	-39.08
Dipole, Da:	2.12
IP(EA), eV:	-9.28(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-2,4,4a,5,6,7,8,8a-octahydro-1H-benzo[d][1,3]oxazine

Drug info:

PubChemData

Smile

C1CCC2C(C1)COC(N2)C3=CC=CC=C3

DOS

IR

Vibrations