Geometry & MOs

Info

ID:	236925
PubChem CID:	92716312
Reduced:	FON4C27H33 (1)
Stoich.:	ABC4D27E33 (1)
Weight, g/mol:	482.24819
ΔH_f, kcal/mol:	-54.23
Dipole, Da:	3.33
IP(EA), eV:	-8.79(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCC[C@H]1NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F

DOS

IR

Vibrations