Geometry & MOs

Info

ID:	199591
PubChem CID:	79268540
Reduced:	N2O3C13H24 (1)
Stoich.:	A2B3C13D24 (1)
Weight, g/mol:	260.083078
ΔH_f, kcal/mol:	-174.84
Dipole, Da:	1.98
IP(EA), eV:	-9.84(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[tert-butyl(1H-pyrrol-3-ylsulfonyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)N(CC(=O)O)C(=O)NC1CCCCC1

DOS

IR

Vibrations