Geometry & MOs

Info

ID:	279108
PubChem CID:	103841222
Reduced:	NO2C17H23 (1)
Stoich.:	AB2C17D23 (1)
Weight, g/mol:	418.86494
ΔH_f, kcal/mol:	-39.36
Dipole, Da:	1.71
IP(EA), eV:	-9.24(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-(2,5-dibromothiophene-3-carbonyl)anilino)acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=CC=CC=C1)NCC2(CC2)C3CC3

DOS

IR

Vibrations