Geometry & MOs

Info

ID:	430886
PubChem CID:	135170953
Reduced:	ON5C24H27 (1)
Stoich.:	AB5C24D27 (1)
Weight, g/mol:	408.227374
ΔH_f, kcal/mol:	48.23
Dipole, Da:	2.61
IP(EA), eV:	-9.08(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]-N-ethyl-1H-benzimidazole-2-carboxamide

Drug info:

PubChemData

Smile

CCN(C1CCCC(C1)NCC2=CC=CC=C2)C(=O)C3=NC4=C(C=CC=C4N3)C#N

DOS

IR

Vibrations