Geometry & MOs

Info

ID:	417470
PubChem CID:	135095126
Reduced:	N2O3C21H32 (1)
Stoich.:	A2B3C21D32 (1)
Weight, g/mol:	310.168128
ΔH_f, kcal/mol:	-127.76
Dipole, Da:	1.83
IP(EA), eV:	-8.67(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,5R)-9-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-7-yl]-naphthalen-2-ylmethanone

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@]12CCCN(C2)CC(=O)NCCC3=CC=C(C=C3)OC

DOS

IR

Vibrations