Geometry & MOs

Info

ID:	374802
PubChem CID:	131346074
Reduced:	NO2F3C10H12 (1)
Stoich.:	AB2C3D10E12 (1)
Weight, g/mol:	243.980633
ΔH_f, kcal/mol:	-239.16
Dipole, Da:	2.22
IP(EA), eV:	-9.5(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,7-dichloro-3H-benzimidazol-5-yl)acetic acid

Drug info:

PubChemData

Smile

CC([C@@H](C1=CC(=C(C=C1)O)C(F)(F)F)N)O

DOS

IR

Vibrations