Geometry & MOs

Info

ID:	71963
PubChem CID:	48415663
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	417.216475
ΔH_f, kcal/mol:	-26.78
Dipole, Da:	7.7
IP(EA), eV:	-8.55(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-[3-(1H-benzimidazol-2-yl)propyl]-3-(1H-indol-3-yl)-N-methylpropanamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)COC

DOS

IR

Vibrations