Geometry & MOs

Info

ID:	71851
PubChem CID:	48415537
Reduced:	ON5C23H33 (1)
Stoich.:	AB5C23D33 (1)
Weight, g/mol:	345.104418
ΔH_f, kcal/mol:	-11.2
Dipole, Da:	4.88
IP(EA), eV:	-8.83(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-5-chloro-2-fluoro-N-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CC(C)C)C)CCC(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations