Geometry & MOs

Info

ID:	54324
PubChem CID:	17032666
Reduced:	FN3O3H24C25 (1)
Stoich.:	AB3C3D24E25 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-76.77
Dipole, Da:	3.76
IP(EA), eV:	-8.35(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-N-ethylacetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CC2=NC3=CC=CC=C3N2CC(=O)NCC4=CC=C(C=C4)F)OC

DOS

IR

Vibrations