Geometry & MOs

Info

ID:	84541
PubChem CID:	49867508
Reduced:	O2C53H80 (1)
Stoich.:	A2B53C80 (1)
Weight, g/mol:	200.93627
ΔH_f, kcal/mol:	-49.14
Dipole, Da:	1.13
IP(EA), eV:	-8.14(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-3-sulfanylselanylpropanoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=O)C(=CC1=O)C/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CCC=C(C)C)C

DOS

IR

Vibrations