Geometry & MOs

Info

ID:	128328
PubChem CID:	51039955
Reduced:	FNO6C12H12 (1)
Stoich.:	ABC6D12E12 (1)
Weight, g/mol:	344.9848
ΔH_f, kcal/mol:	-275.52
Dipole, Da:	2.85
IP(EA), eV:	-9.58(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-bromo-2-methoxycarbonylanilino)-2-oxoethoxy]acetic acid

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CC(=C1)F)NC(=O)COCC(=O)O

DOS

IR

Vibrations