Geometry & MOs

Info

ID:	42925
PubChem CID:	10317171
Reduced:	N2O3H20C23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	372.172545
ΔH_f, kcal/mol:	-38.51
Dipole, Da:	4.86
IP(EA), eV:	-8.54(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[4-(9H-fluoren-9-yl)butoxy]benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(N1CC3=CC=CC=C3)C=CC(=O)N2C4=CC=CC=C4

DOS

IR

Vibrations