Geometry & MOs

Info

ID:	419859
PubChem CID:	135109445
Reduced:	OSN3C21H25 (1)
Stoich.:	ABC3D21E25 (1)
Weight, g/mol:	331.144453
ΔH_f, kcal/mol:	-1.46
Dipole, Da:	2.93
IP(EA), eV:	-8.89(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CCSCC(=O)N1CCCC2(C1)CCC3=CN=C(N=C23)C4=CC=CC=C4

DOS

IR

Vibrations