Geometry & MOs

Info

ID:	447227
PubChem CID:	135281318
Reduced:	NO4C6H9 (2)
Stoich.:	AB4C6D9 (2)
Weight, g/mol:	346.137616
ΔH_f, kcal/mol:	-323.18
Dipole, Da:	4.9
IP(EA), eV:	-10.27(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-prop-2-enoyloxybutanoic acid;(2S)-3-hydroxy-2-(prop-2-enoylamino)butanoic acid

Drug info:

PubChemData

Smile

C=CC(=O)NC(CO)C(=O)O.C=CC(=O)OCC(C(=O)O)N

DOS

IR

Vibrations