Geometry & MOs

Info

ID:	295374
PubChem CID:	117527560
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	246.173213
ΔH_f, kcal/mol:	-49.5
Dipole, Da:	6.73
IP(EA), eV:	-9.02(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethyl-1-methylbenzimidazol-5-yl)-3-methylbutan-1-ol

Drug info:

PubChemData

Smile

CCC1=NC2=C(N1C)C=CC(=C2)C3(CCC3)C(=O)O

DOS

IR

Vibrations