Geometry & MOs

Info

ID:	240342
PubChem CID:	93577008
Reduced:	O2F3N3H18C20 (1)
Stoich.:	A2B3C3D18E20 (1)
Weight, g/mol:	344.129156
ΔH_f, kcal/mol:	-177.37
Dipole, Da:	5.65
IP(EA), eV:	-9.32(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[1-[2-(4-chlorophenoxy)ethyl]-5,6-dimethylbenzimidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

C1C[C@H](OC1)C2=NC3=CC=CC=C3N2CC(=O)NC4=CC=CC(=C4)C(F)(F)F

DOS

IR

Vibrations