Geometry & MOs

Info

ID:	435493
PubChem CID:	135191613
Reduced:	N3O4H15C17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	210.080456
ΔH_f, kcal/mol:	-68.6
Dipole, Da:	3.41
IP(EA), eV:	-9.0(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-1,2-dimethyl-2,3-dihydrobenzimidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(O/C(=C\C2=CNC3=C2C=CC=N3)/C1=O)NC=C

DOS

IR

Vibrations