Geometry & MOs

Info

ID:	203096
PubChem CID:	79778397
Reduced:	ON5C10H13 (1)
Stoich.:	AB5C10D13 (1)
Weight, g/mol:	298.01883
ΔH_f, kcal/mol:	32.16
Dipole, Da:	3.48
IP(EA), eV:	-8.49(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-(chloromethyl)-6-fluoro-1-(1-methylpyrazol-4-yl)benzimidazole

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)OC)NC2=NN(C=C2)C

DOS

IR

Vibrations