Geometry & MOs

Info

ID:	222165
PubChem CID:	85294891
Reduced:	NO3C6H9 (1)
Stoich.:	AB3C6D9 (1)
Weight, g/mol:	143.094629
ΔH_f, kcal/mol:	-35.38
Dipole, Da:	4.65
IP(EA), eV:	-10.25(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-aminoethyl)pent-4-enoic acid

Drug info:

PubChemData

Smile

CC(=CC=CCO)[N+](=O)[O-]

DOS

IR

Vibrations