Geometry & MOs

Info

ID:	261501
PubChem CID:	103236703
Reduced:	INO3C12H16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	426.82412
ΔH_f, kcal/mol:	-110.03
Dipole, Da:	4.99
IP(EA), eV:	-8.6(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-2-(2,4,6-tribromoanilino)acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)CC(CNC1=CC(=CC=C1)I)O

DOS

IR

Vibrations