Geometry & MOs

Info

ID:	22279
PubChem CID:	596509
Reduced:	N2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	262.131742
ΔH_f, kcal/mol:	-45.05
Dipole, Da:	6.61
IP(EA), eV:	-9.81(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-nitrophenyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-benzo[e][1,3]oxazine

Drug info:

PubChemData

Smile

C1CCC2C(C1)CNC(O2)C3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations