Geometry & MOs

Info

ID:	242490
PubChem CID:	96107413
Reduced:	N2O4C13H16 (1)
Stoich.:	A2B4C13D16 (1)
Weight, g/mol:	266.106671
ΔH_f, kcal/mol:	-138.67
Dipole, Da:	5.32
IP(EA), eV:	-8.69(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[6-fluoro-2-[(1R)-1-hydroxyethyl]benzimidazol-1-yl]propanoate

Drug info:

PubChemData

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C[C@H](C1=NC2=C(N1[C@H](C)C(=O)OC)C=CC(=C2)O)O

DOS

IR

Vibrations