Geometry & MOs

Info

ID:	72264
PubChem CID:	48415984
Reduced:	O2N5C23H25 (1)
Stoich.:	A2B5C23D25 (1)
Weight, g/mol:	411.05824
ΔH_f, kcal/mol:	15.72
Dipole, Da:	5.66
IP(EA), eV:	-8.94(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-7-bromo-N-methyl-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCCC3=NN=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations