Geometry & MOs

Info

ID:	297331
PubChem CID:	117615203
Reduced:	N2C13H19 (2)
Stoich.:	A2B13C19 (2)
Weight, g/mol:	392.293997
ΔH_f, kcal/mol:	14.77
Dipole, Da:	4.96
IP(EA), eV:	-8.7(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(azetidin-3-yl)-1-[8-[(1R)-1-cyclohexylethyl]-8-azabicyclo[3.2.1]octan-3-yl]benzimidazole

Drug info:

PubChemData

Smile

C[C@H](C1CCCCC1)N2C3CCC2CC(C3)N4C5=CC=CC=C5N=C4[C@H]6CCNC6

DOS

IR

Vibrations