Geometry & MOs

Info

ID:	408252
PubChem CID:	135081014
Reduced:	PC7O8H15 (1)
Stoich.:	AB7C8D15 (1)
Weight, g/mol:	215.115758
ΔH_f, kcal/mol:	-416.9
Dipole, Da:	2.12
IP(EA), eV:	-9.98(0.11)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

2-amino-3-hexylbutanedioate

Drug info:

PubChemData

Smile

C(CP(=O)(O)O)C(=O)C(C([C@H](CO)O)O)O

DOS

IR

Vibrations