Geometry & MOs

Info

ID:	337763
PubChem CID:	127258386
Reduced:	SeO4C11H12 (1)
Stoich.:	AB4C11D12 (1)
Weight, g/mol:	249.078327
ΔH_f, kcal/mol:	-153.18
Dipole, Da:	2.84
IP(EA), eV:	-8.64(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(diaminomethylideneamino)propylsulfanyl]butanedioic acid

Drug info:

PubChemData

Smile

COC(=O)CCC(=O)O[Se]C1=CC=CC=C1

DOS

IR

Vibrations