Geometry & MOs

Info

ID:	390855
PubChem CID:	135001298
Reduced:	ClNH9C13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	355.158372
ΔH_f, kcal/mol:	127.89
Dipole, Da:	3.33
IP(EA), eV:	-9.24(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (4R)-4-(5-fluoro-1-methyl-4,7-dihydroindol-2-yl)-2-oxo-4-phenylbutanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C(=N\N=C(\C2=CC=CC=C2)/C3=CC=C(C=C3)Cl)/C4=CC=C(C=C4)Cl

DOS

IR

Vibrations