Geometry & MOs

Info

ID:	69785
PubChem CID:	47205392
Reduced:	ClFOSN2H12C14 (1)
Stoich.:	ABCDE2F12G14 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	-34.11
Dipole, Da:	6.51
IP(EA), eV:	-9.27(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1H-benzimidazol-2-yl)-N-(2-cyanopropyl)-N-methylpropanamide

Drug info:

PubChemData

Smile

CC(CN(C)C(=O)C1=C(C2=C(S1)C=C(C=C2)F)Cl)C#N

DOS

IR

Vibrations