Geometry & MOs

Info

ID:	162664
PubChem CID:	57551346
Reduced:	FON3H26C28 (1)
Stoich.:	ABC3D26E28 (1)
Weight, g/mol:	468.242436
ΔH_f, kcal/mol:	-9.91
Dipole, Da:	4.41
IP(EA), eV:	-8.2(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-[3-[2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethylcarbamoyl]phenoxy]hexanoate

Drug info:

PubChemData

Smile

CC1=C2C(=C(NC2=C(C=C1)F)C)CCNC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5N4C

DOS

IR

Vibrations