Geometry & MOs

Info

ID:	146449
PubChem CID:	53691177
Reduced:	O3H20C25 (1)
Stoich.:	A3B20C25 (1)
Weight, g/mol:	391.9694
ΔH_f, kcal/mol:	-1.16
Dipole, Da:	8.18
IP(EA), eV:	-9.14(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-bromo-5,6-dichlorobenzimidazol-1-yl)-2-(hydroxymethyl)cyclopentyl]methanol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C=CC#CC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)CCO

DOS

IR

Vibrations