Geometry & MOs

Info

ID:	202298
PubChem CID:	79653301
Reduced:	ON4C12H22 (1)
Stoich.:	AB4C12D22 (1)
Weight, g/mol:	229.167794
ΔH_f, kcal/mol:	27.74
Dipole, Da:	2.45
IP(EA), eV:	-8.85(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-3-(3,3-dimethylbutoxy)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(CN)CN(C)CC1=NOC(=N1)C2CC2

DOS

IR

Vibrations