Geometry & MOs

Info

ID:	228041
PubChem CID:	87563264
Reduced:	N2O4F6H18C21 (1)
Stoich.:	A2B4C6D18E21 (1)
Weight, g/mol:	197.94453
ΔH_f, kcal/mol:	-363.13
Dipole, Da:	7.83
IP(EA), eV:	-9.92(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-bromo-2-phosphanylacetate

Drug info:

PubChemData

Smile

CC(C)CC(C1=CC(=C(C(=C1)OCC(F)(F)F)C2=CC3=NON=C3C=C2)C(F)(F)F)C(=O)O

DOS

IR

Vibrations