Geometry & MOs

Info

ID:	45318
PubChem CID:	10511120
Reduced:	ClN2C7H9 (1)
Stoich.:	AB2C7D9 (1)
Weight, g/mol:	158.094294
ΔH_f, kcal/mol:	6.92
Dipole, Da:	4.18
IP(EA), eV:	-8.62(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1S,2R)-2-hydroxycyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=NC(=C1N)Cl)C

DOS

IR

Vibrations