Geometry & MOs

Info

ID:	68313
PubChem CID:	46508172
Reduced:	SF3N3O5C20H24 (1)
Stoich.:	AB3C3D5E20F24 (1)
Weight, g/mol:	421.136174
ΔH_f, kcal/mol:	-322.14
Dipole, Da:	8.0
IP(EA), eV:	-8.99(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-methyl-N'-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]benzimidazole-5-carbohydrazide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC)NC(=O)C2=CN=C(C=C2)OCC(F)(F)F

DOS

IR

Vibrations