Geometry & MOs

Info

ID:	186068
PubChem CID:	77386141
Reduced:	NO3C31H33 (1)
Stoich.:	AB3C31D33 (1)
Weight, g/mol:	378.183109
ΔH_f, kcal/mol:	-66.05
Dipole, Da:	4.07
IP(EA), eV:	-8.7(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(9H-fluoren-2-yl)-2-pentoxy-3,4-dihydro-2H-pyran-6-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCOC1CC(C=C(O1)C(=O)NCC2=CC=CC=C2)C3=CC4=C(C=C3)C5=CC=CC=C5C4

DOS

IR

Vibrations