Geometry & MOs

Info

ID:	49049
PubChem CID:	11528654
Reduced:	O2F3N3H6C7 (1)
Stoich.:	A2B3C3D6E7 (1)
Weight, g/mol:	221.068808
ΔH_f, kcal/mol:	-105.2
Dipole, Da:	4.57
IP(EA), eV:	-10.13(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyethyl)-3,1-benzoxazine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C(F)(F)F)N(N=O)O

DOS

IR

Vibrations