Geometry & MOs

Info

ID:	57250
PubChem CID:	22395540
Reduced:	N2O2C17H18 (1)
Stoich.:	A2B2C17D18 (1)
Weight, g/mol:	511.178358
ΔH_f, kcal/mol:	-43.17
Dipole, Da:	5.56
IP(EA), eV:	-8.41(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[9H-fluoren-9-ylmethoxycarbonyl(pyren-1-yl)amino]propanoic acid

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C3=C1C(=CC=C3)NC(C)C(=O)O

DOS

IR

Vibrations