Geometry & MOs

Info

ID:	204809
PubChem CID:	80011173
Reduced:	NO2C6H8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	283.087829
ΔH_f, kcal/mol:	-118.34
Dipole, Da:	7.11
IP(EA), eV:	-9.85(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(4,5-dimethylthiophene-2-carbonyl)amino]methyl]oxolane-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CC1CNCC(=O)NCC2=CC=C(O2)C(=O)O

DOS

IR

Vibrations