Geometry & MOs

Info

ID:	204808
PubChem CID:	80011018
Reduced:	NO5C13H15 (1)
Stoich.:	AB5C13D15 (1)
Weight, g/mol:	252.111007
ΔH_f, kcal/mol:	-193.77
Dipole, Da:	3.79
IP(EA), eV:	-9.45(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[[2-(cyclopropylmethylamino)acetyl]amino]methyl]furan-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(OC1CNC(=O)OC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations