Geometry & MOs

Info

ID:	231140
PubChem CID:	87572744
Reduced:	SN2O5C10H20 (1)
Stoich.:	AB2C5D10E20 (1)
Weight, g/mol:	356.267508
ΔH_f, kcal/mol:	-217.49
Dipole, Da:	4.84
IP(EA), eV:	-9.56(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-5-amino-2-(dodecanoylamino)-5-oxopentanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NN1CC(C1)COS(=O)(=O)C

DOS

IR

Vibrations