Geometry & MOs

Info

ID:	124288
PubChem CID:	50877075
Reduced:	ClON2H11C15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	250.087291
ΔH_f, kcal/mol:	39.93
Dipole, Da:	3.27
IP(EA), eV:	-9.24(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-butan-2-yl-5-chlorobenzimidazol-2-yl)ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2C=O

DOS

IR

Vibrations