Geometry & MOs

Info

ID:	201718
PubChem CID:	79570708
Reduced:	NOC16H29 (1)
Stoich.:	ABC16D29 (1)
Weight, g/mol:	227.188529
ΔH_f, kcal/mol:	-83.45
Dipole, Da:	3.38
IP(EA), eV:	-8.51(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[ethyl(1-methoxypropan-2-yl)amino]ethyl]cyclopentan-1-one

Drug info:

PubChemData

Smile

CCC1CCC(CC1)N(C)CCC2CCCC2=O

DOS

IR

Vibrations