Geometry & MOs

Info

ID:	214036
PubChem CID:	81065885
Reduced:	NSO3C15H21 (1)
Stoich.:	ABC3D15E21 (1)
Weight, g/mol:	225.100108
ΔH_f, kcal/mol:	-130.71
Dipole, Da:	2.0
IP(EA), eV:	-8.82(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(furan-2-carbonylamino)methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)CCSC1=CC=CC=C1

DOS

IR

Vibrations