Geometry & MOs

Info

ID:	261550
PubChem CID:	103240009
Reduced:	NO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	225.172879
ΔH_f, kcal/mol:	-94.72
Dipole, Da:	7.0
IP(EA), eV:	-9.04(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclopentylethylamino)-2-ethylbut-2-enoic acid

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)CNCC(=C)C(=O)O

DOS

IR

Vibrations