Geometry & MOs

Info

ID:	326824
PubChem CID:	126688296
Reduced:	SN4O6C25H28 (1)
Stoich.:	AB4C6D25E28 (1)
Weight, g/mol:	426.170333
ΔH_f, kcal/mol:	-181.54
Dipole, Da:	7.66
IP(EA), eV:	-8.66(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(fluoromethyl)-N-[1-(3-hydroxypropyl)-5-(3-oxomorpholin-4-yl)benzimidazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=NC3=C(N2C4CCC(CC4)O)C=CC(=C3)N5CCOCC5=O

DOS

IR

Vibrations