Geometry & MOs

Info

ID:	136093
PubChem CID:	51977379
Reduced:	ClON3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	349.155705
ΔH_f, kcal/mol:	-22.81
Dipole, Da:	2.15
IP(EA), eV:	-8.88(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[6-chloro-2-[(2R)-oxolan-2-yl]benzimidazol-1-yl]propyl]morpholine

Drug info:

PubChemData

Smile

C[C@H](C1=NC2=C(N1CCCN(C)C)C=C(C=C2)Cl)O

DOS

IR

Vibrations