Geometry & MOs

Info

ID:	71878
PubChem CID:	48415568
Reduced:	O3N4C23H24 (1)
Stoich.:	A3B4C23D24 (1)
Weight, g/mol:	349.124883
ΔH_f, kcal/mol:	-70.19
Dipole, Da:	3.74
IP(EA), eV:	-9.13(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)CN4C(=O)CCC4=O

DOS

IR

Vibrations