Geometry & MOs

Info

ID:	72173
PubChem CID:	48415889
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	410.211804
ΔH_f, kcal/mol:	-45.23
Dipole, Da:	7.45
IP(EA), eV:	-8.64(-0.25)
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]-2-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)C)C)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations