Geometry & MOs

Info

ID:	182283
PubChem CID:	76870669
Reduced:	Cl2O3N4C23H32 (1)
Stoich.:	A2B3C4D23E32 (1)
Weight, g/mol:	464.13184
ΔH_f, kcal/mol:	-151.35
Dipole, Da:	5.64
IP(EA), eV:	-8.98(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-fluorophenyl)methyl]-3H-benzimidazol-5-yl]-3-[4-(methylsulfamoyl)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CN(C)CCCN(CC1=CC(=C(C=C1)Cl)Cl)C(=O)CCN2C3CCCCC3C(=O)NC2=O

DOS

IR

Vibrations