Geometry & MOs

Info

ID:	338376
PubChem CID:	127259068
Reduced:	NF2O3H7C9 (1)
Stoich.:	AB2C3D7E9 (1)
Weight, g/mol:	185.043656
ΔH_f, kcal/mol:	-194.47
Dipole, Da:	3.87
IP(EA), eV:	-9.54(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-N-(2-amino-2-oxoethoxy)-C-cyanocarbonimidoyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC(=O)NC1=C(C=CC=C1F)F

DOS

IR

Vibrations