Geometry & MOs

Info

ID:	261710
PubChem CID:	103246858
Reduced:	NO3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	241.131408
ΔH_f, kcal/mol:	-108.11
Dipole, Da:	4.64
IP(EA), eV:	-9.24(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(furan-2-yl)butan-2-ylamino]-3-hydroxybutanoic acid

Drug info:

PubChemData

Smile

CC(CCC1=CC=CO1)NC2CCC2C(=O)O

DOS

IR

Vibrations