Geometry & MOs

Info

ID:	58498
PubChem CID:	24702066
Reduced:	NOC12H17 (1)
Stoich.:	ABC12D17 (1)
Weight, g/mol:	286.97932
ΔH_f, kcal/mol:	-32.08
Dipole, Da:	2.72
IP(EA), eV:	-8.72(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-bromo-5-methoxybenzoyl)amino]acetic acid

Drug info:

PubChemData

Smile

CCCNC1CCOC2=CC=CC=C12

DOS

IR

Vibrations