Geometry & MOs

Info

ID:	28878
PubChem CID:	830208
Reduced:	N2O3H16C19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	232.157563
ΔH_f, kcal/mol:	-12.49
Dipole, Da:	2.82
IP(EA), eV:	-8.33(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[1-[(2R)-2-methylbutyl]benzimidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)C(=N2)C

DOS

IR

Vibrations