Geometry & MOs

Info

ID:	336530
PubChem CID:	127255537
Reduced:	OCl2N2C8H18 (1)
Stoich.:	AB2C2D8E18 (1)
Weight, g/mol:	396.168522
ΔH_f, kcal/mol:	-116.01
Dipole, Da:	6.09
IP(EA), eV:	-9.3(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-5-amino-2-[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

C1CNC[C@H]1N2CCOCC2.Cl.Cl

DOS

IR

Vibrations