Geometry & MOs

Info

ID:	16761
PubChem CID:	476504
Reduced:	N4O5H18C20 (1)
Stoich.:	A4B5C18D20 (1)
Weight, g/mol:	394.12772
ΔH_f, kcal/mol:	-25.11
Dipole, Da:	10.42
IP(EA), eV:	-9.6(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6S)-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazin-6-yl]-4-phenylmethoxybenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations