Geometry & MOs

Info

ID:	161458
PubChem CID:	57391722
Reduced:	ClS2N3O5C31H44 (1)
Stoich.:	AB2C3D5E31F44 (1)
Weight, g/mol:	346.146999
ΔH_f, kcal/mol:	-211.22
Dipole, Da:	4.84
IP(EA), eV:	-9.2(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-phenylphenyl)phenyl]-1H-benzimidazole

Drug info:

PubChemData

Smile

CCN(C1CCN(CC1)CC[C@H](C2CCN(CC2)S(=O)(=O)C)C3=CC(=CC=C3)Cl)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C

DOS

IR

Vibrations