Geometry & MOs

Info

ID:	267511
PubChem CID:	103582475
Reduced:	BrClN2H12C14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	353.97707
ΔH_f, kcal/mol:	69.68
Dipole, Da:	2.08
IP(EA), eV:	-8.87(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5-bromo-3-chloropyridin-2-yl)amino]-2-phenylacetate

Drug info:

PubChemData

Smile

C1C(C1NC2=C(C=C(C=N2)Br)Cl)C3=CC=CC=C3

DOS

IR

Vibrations