Geometry & MOs

Info

ID:	199593
PubChem CID:	79268542
Reduced:	FNSO4C13H18 (1)
Stoich.:	ABCD4E13F18 (1)
Weight, g/mol:	258.157957
ΔH_f, kcal/mol:	-222.38
Dipole, Da:	3.58
IP(EA), eV:	-9.89(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[tert-butyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)S(=O)(=O)N(CC(=O)O)C(C)(C)C

DOS

IR

Vibrations