Geometry & MOs

Info

ID:	285561
PubChem CID:	104113317
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	222.064057
ΔH_f, kcal/mol:	-107.58
Dipole, Da:	8.12
IP(EA), eV:	-9.23(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[furan-3-ylmethyl(methyl)amino]-1,3-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CN(C1CCCCCC1)C2=NC(=CO2)C(=O)O

DOS

IR

Vibrations