Geometry & MOs

Info

ID:	204749
PubChem CID:	80003210
Reduced:	N4O4C13H16 (1)
Stoich.:	A4B4C13D16 (1)
Weight, g/mol:	298.116486
ΔH_f, kcal/mol:	-108.33
Dipole, Da:	3.27
IP(EA), eV:	-9.43(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[[(3-ethoxy-3-oxopropyl)-methylcarbamoyl]amino]methyl]furan-2-carboxylic acid

Drug info:

PubChemData

Smile

CN1C=CN=C1CCNC(=O)NCC2=CC=C(O2)C(=O)O

DOS

IR

Vibrations