Geometry & MOs

Info

ID:	16760
PubChem CID:	476502
Reduced:	N3O5H19C20 (1)
Stoich.:	A3B5C19D20 (1)
Weight, g/mol:	381.132471
ΔH_f, kcal/mol:	-22.79
Dipole, Da:	11.52
IP(EA), eV:	-9.45(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-2-nitro-6-[(3-phenylmethoxyphenyl)methoxy]-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine

Drug info:

PubChemData

Smile

C1[C@@H](COC2=NC(=CN21)[N+](=O)[O-])OCC3=CC(=CC=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations