Geometry & MOs

Info

ID:	150962
PubChem CID:	53790659
Reduced:	NO3C10H11 (1)
Stoich.:	AB3C10D11 (1)
Weight, g/mol:	283.051444
ΔH_f, kcal/mol:	-75.94
Dipole, Da:	3.08
IP(EA), eV:	-9.09(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[(2R)-2-amino-3-sulfanylpropanoyl]oxy-4-hydroxyphenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CC(=O)/C=C/C1=CC(=C(C=N1)O)OC

DOS

IR

Vibrations