Geometry & MOs

Info

ID:	422564
PubChem CID:	135118045
Reduced:	OSN5C15H21 (1)
Stoich.:	ABC5D15E21 (1)
Weight, g/mol:	290.174276
ΔH_f, kcal/mol:	36.54
Dipole, Da:	4.96
IP(EA), eV:	-8.92(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5R)-7-[[6-(dimethylamino)pyridin-3-yl]methyl]-3-oxa-7,9-diazabicyclo[3.3.2]decan-10-one

Drug info:

PubChemData

Smile

CCC(C(=O)NC1=NC=CS1)N(C)CC2=CC(=NN2)C3CC3

DOS

IR

Vibrations