Geometry & MOs

Info

ID:	863
PubChem CID:	3452
Reduced:	NO2C6H9 (1)
Stoich.:	AB2C6D9 (1)
Weight, g/mol:	127.063329
ΔH_f, kcal/mol:	-38.89
Dipole, Da:	5.17
IP(EA), eV:	-9.83(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-aminohex-5-ynoic acid

Drug info:

PubChemData

Smile

C#CC(CCC(=O)O)N

DOS

IR

Vibrations