Geometry & MOs

Info

ID:	232848
PubChem CID:	87577225
Reduced:	O6C13H24 (1)
Stoich.:	A6B13C24 (1)
Weight, g/mol:	479.182313
ΔH_f, kcal/mol:	-305.09
Dipole, Da:	1.69
IP(EA), eV:	-10.58(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-aminopropanoic acid;carbonochloridic acid;2-phenyl-2-prop-2-enyl-3-pyrazin-2-ylhexanoic acid

Drug info:

PubChemData

Smile

CC(C)C(C)(O)O.CC(=C)C(=O)O.CC(=C)C(=O)O

DOS

IR

Vibrations