Geometry & MOs

Info

ID:	234537
PubChem CID:	92298630
Reduced:	O4N7C34H35 (1)
Stoich.:	A4B7C34D35 (1)
Weight, g/mol:	336.183778
ΔH_f, kcal/mol:	-6.52
Dipole, Da:	5.82
IP(EA), eV:	-8.54(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-3-phenylmethoxybenzamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CNC(=O)[C@H](C2=CC=C(C=C2)N3CCOCC3)N(C4=CC5=CC=CC=C5N=C4)C(=O)CN6C7=CC=CC=C7N=N6

DOS

IR

Vibrations