Geometry & MOs

Info

ID:	228451
PubChem CID:	87564554
Reduced:	BrNOC10H12 (1)
Stoich.:	ABCD10E12 (1)
Weight, g/mol:	267.087174
ΔH_f, kcal/mol:	9.96
Dipole, Da:	3.8
IP(EA), eV:	-9.69(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2-diethoxyphosphorylacetyl)amino]acetate

Drug info:

PubChemData

Smile

C1C(O1)CC(C2=CC(=CC=C2)Br)N

DOS

IR

Vibrations