Geometry & MOs

Info

ID:	213808
PubChem CID:	81065057
Reduced:	NO4C16H19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	263.115758
ΔH_f, kcal/mol:	-156.04
Dipole, Da:	6.41
IP(EA), eV:	-9.25(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1-benzofuran-5-carbonylamino)-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=CO2)CC(=O)NCC(C)CC(=O)O

DOS

IR

Vibrations