Geometry & MOs

Info

ID:	423748
PubChem CID:	135120152
Reduced:	NO5C23H25 (1)
Stoich.:	AB5C23D25 (1)
Weight, g/mol:	365.210327
ΔH_f, kcal/mol:	-184.44
Dipole, Da:	7.15
IP(EA), eV:	-9.15(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,5R)-6-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-3,6-diazabicyclo[3.2.2]nonan-3-yl]ethanone

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)C(=O)N3CC[C@@H]([C@@](C3)(CC4=CC=CC=C4)C(=O)O)O)OC1

DOS

IR

Vibrations