Geometry & MOs

Info

ID:	71849
PubChem CID:	48415535
Reduced:	OSN6C18H24 (1)
Stoich.:	ABC6D18E24 (1)
Weight, g/mol:	395.141596
ΔH_f, kcal/mol:	26.22
Dipole, Da:	4.45
IP(EA), eV:	-8.71(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CCCC1=NNC(=S)N1CC(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations