Geometry & MOs

Info

ID:

389648

PubChem CID:

134994255

Reduced:

N2O3C7H18 (1)

Stoich.:

A2B3C7D18 (1)

Weight, g/mol:

205.110279

ΔHf, kcal/mol:

-86.09

Dipole, Da:

1.8

IP(EA), eV:

-9.87(1.14)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2S,3aS)-2-phenyl-2,3,3a,4,5,6-hexahydro-[1,2]oxazolo[2,3-b]oxazine

Drug info:

PubChemData

Smile

C(CCOCCON)CCON

DOS

IR

Vibrations