Geometry & MOs

Info

ID:	390806
PubChem CID:	135001046
Reduced:	ON2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	283.137242
ΔH_f, kcal/mol:	1.31
Dipole, Da:	3.04
IP(EA), eV:	-8.34(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-(5-fluoro-4,7-dihydro-1H-indol-2-yl)-4-phenylbutan-2-one

Drug info:

PubChemData

Smile

C[C@H]1CC2=NC3=C(N2C1)C=C(C=C3)OC

DOS

IR

Vibrations