Geometry & MOs

Info

ID:	200874
PubChem CID:	79457395
Reduced:	N2O4C11H18 (1)
Stoich.:	A2B4C11D18 (1)
Weight, g/mol:	286.12772
ΔH_f, kcal/mol:	-169.8
Dipole, Da:	6.98
IP(EA), eV:	-9.56(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(2-methyl-4-nitro-5-propan-2-ylpyrazol-3-yl)amino]ethoxy]acetic acid

Drug info:

PubChemData

Smile

C1CC2C(CC1N2)C(=O)NCCOCC(=O)O

DOS

IR

Vibrations