Geometry & MOs

Info

ID:	202275
PubChem CID:	79650564
Reduced:	N2O2C13H26 (1)
Stoich.:	A2B2C13D26 (1)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-108.47
Dipole, Da:	3.0
IP(EA), eV:	-8.76(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(1,3-dihydroisoindol-2-yl)-1-(methylamino)cyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CCCCN(C)C1CCC(C1)(C(=O)OC)NC

DOS

IR

Vibrations