Geometry & MOs

Info

ID:	391520
PubChem CID:	135006181
Reduced:	NO4H15C17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	319.14514
ΔH_f, kcal/mol:	-41.01
Dipole, Da:	5.47
IP(EA), eV:	-9.68(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S)-3-benzyl-3,6-dihydro-2H-1,4-oxazin-4-ium-5-yl]-2-phenylhydrazine;molecular hydrogen;chloride

Drug info:

PubChemData

Smile

C1[C@H](C2=C(C=CC(=C2)[N+](=O)[O-])OC1O)/C=C/C3=CC=CC=C3

DOS

IR

Vibrations