Geometry & MOs

Info

ID:	295373
PubChem CID:	117527559
Reduced:	N3C17H23 (1)
Stoich.:	A3B17C23 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	60.34
Dipole, Da:	4.91
IP(EA), eV:	-8.58(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethyl-1-methylbenzimidazol-5-yl)cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

CNCC1(CCC1)C2=CC3=C(C=C2)N(C(=N3)C4CC4)C

DOS

IR

Vibrations