Geometry & MOs

Info

ID:	350348
PubChem CID:	127277426
Reduced:	O3N4C13H20 (1)
Stoich.:	A3B4C13D20 (1)
Weight, g/mol:	322.225643
ΔH_f, kcal/mol:	-88.61
Dipole, Da:	3.6
IP(EA), eV:	-9.07(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide

Drug info:

PubChemData

Smile

COCCN1CCCC1CNC(=O)C2=NNC(=O)C=C2

DOS

IR

Vibrations