Geometry & MOs

Info

ID:	150660
PubChem CID:	53790354
Reduced:	O3C40H58 (1)
Stoich.:	A3B40C58 (1)
Weight, g/mol:	299.095771
ΔH_f, kcal/mol:	-168.52
Dipole, Da:	2.84
IP(EA), eV:	-8.39(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluorophenyl)methyl 5-hydroxy-2-methyl-1H-indole-3-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)CCC3=CC=C(C=C3)C(=O)OC[C@H](C)CCCCCCCC

DOS

IR

Vibrations