Geometry & MOs

Info

ID:	873
PubChem CID:	3464
Reduced:	SN3O4C7H13 (1)
Stoich.:	AB3C4D7E13 (1)
Weight, g/mol:	235.062677
ΔH_f, kcal/mol:	-166.13
Dipole, Da:	5.3
IP(EA), eV:	-9.42(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid

Drug info:

PubChemData

Smile

C(CSC(CC(=O)O)C(=O)O)N=C(N)N

DOS

IR

Vibrations