Geometry & MOs

Info

ID:	213209
PubChem CID:	81063172
Reduced:	N2O5C14H20 (1)
Stoich.:	A2B5C14D20 (1)
Weight, g/mol:	239.115758
ΔH_f, kcal/mol:	-195.9
Dipole, Da:	5.99
IP(EA), eV:	-9.72(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)CN(C)C(=O)C1=CC=CO1

DOS

IR

Vibrations