Geometry & MOs

Info

ID:	213752
PubChem CID:	81064871
Reduced:	NO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	282.121572
ΔH_f, kcal/mol:	-106.9
Dipole, Da:	2.74
IP(EA), eV:	-9.57(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(furan-2-carbonylamino)propanoylamino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNC(=O)C1(CC1)C2=CC=CC=C2

DOS

IR

Vibrations