Geometry & MOs

Info

ID:	350736
PubChem CID:	127279024
Reduced:	ON3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	266.199428
ΔH_f, kcal/mol:	-20.22
Dipole, Da:	3.86
IP(EA), eV:	-8.96(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,2-dimethylpyrrolidin-1-yl)-2-oxoethyl]azocan-2-one

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)C2=NNC3=C2CCC3)C

DOS

IR

Vibrations