Geometry & MOs

Info

ID:	199605
PubChem CID:	79269102
Reduced:	NO2C15H31 (1)
Stoich.:	AB2C15D31 (1)
Weight, g/mol:	294.124943
ΔH_f, kcal/mol:	-146.89
Dipole, Da:	4.26
IP(EA), eV:	-8.98(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-amino-3-oxopropyl)sulfonylethyl-tert-butylamino]acetic acid

Drug info:

PubChemData

Smile

CCCCCCCCCN(CC(=O)O)C(C)(C)C

DOS

IR

Vibrations