Geometry & MOs

Info

ID:	258881
PubChem CID:	103157328
Reduced:	NO2C6H12 (2)
Stoich.:	AB2C6D12 (2)
Weight, g/mol:	229.167794
ΔH_f, kcal/mol:	-209.22
Dipole, Da:	3.19
IP(EA), eV:	-9.38(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(3-cyclopentyl-2-hydroxypropyl)amino]acetate

Drug info:

PubChemData

Smile

CC(C)CC(CN)C(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations