Geometry & MOs

Info

ID:	275981
PubChem CID:	103819698
Reduced:	NO5C23H23 (1)
Stoich.:	AB5C23D23 (1)
Weight, g/mol:	415.141973
ΔH_f, kcal/mol:	-176.98
Dipole, Da:	2.83
IP(EA), eV:	-9.1(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-4-phenylbutanoic acid

Drug info:

PubChemData

Smile

C1CC(CC(=O)C1)C(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

DOS

IR

Vibrations