Geometry & MOs

Info

ID:	240007
PubChem CID:	93575673
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	434.156575
ΔH_f, kcal/mol:	-41.68
Dipole, Da:	6.29
IP(EA), eV:	-9.02(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]benzimidazol-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CCCC(=O)N[C@H](C)C1=NC2=CC=CC=C2N1CC(=O)NCC=C

DOS

IR

Vibrations