Geometry & MOs

Info

ID:	249430
PubChem CID:	103089379
Reduced:	NSO3C10H19 (1)
Stoich.:	ABC3D10E19 (1)
Weight, g/mol:	427.18173
ΔH_f, kcal/mol:	-148.27
Dipole, Da:	2.49
IP(EA), eV:	-8.88(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[9H-fluoren-9-ylmethoxycarbonyl(propyl)amino]-5-methylsulfanylpentanoic acid

Drug info:

PubChemData

Smile

CC(C)N(C=O)C(CCCSC)C(=O)O

DOS

IR

Vibrations