Geometry & MOs

Info

ID:	280561
PubChem CID:	103849903
Reduced:	O2S2N3C12H17 (1)
Stoich.:	A2B2C3D12E17 (1)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-36.23
Dipole, Da:	8.58
IP(EA), eV:	-10.07(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[1-(1H-benzimidazol-2-yl)ethyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(S1)S(=O)(=O)NC(C#N)C2CCCCC2

DOS

IR

Vibrations