Geometry & MOs

Info

ID:	71954
PubChem CID:	48415654
Reduced:	O3N4C22H28 (1)
Stoich.:	A3B4C22D28 (1)
Weight, g/mol:	410.211804
ΔH_f, kcal/mol:	-104.76
Dipole, Da:	4.82
IP(EA), eV:	-9.03(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[3-(1H-benzimidazol-2-yl)propyl-methylamino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCN3C(=O)C4CCCCC4C3=O

DOS

IR

Vibrations