Geometry & MOs

Info

ID:	235277
PubChem CID:	92304331
Reduced:	FON2C24H29 (1)
Stoich.:	ABC2D24E29 (1)
Weight, g/mol:	380.226392
ΔH_f, kcal/mol:	-68.21
Dipole, Da:	4.78
IP(EA), eV:	-8.29(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(1-ethylindol-3-yl)-3-(3-fluorophenyl)-N-[(2R)-3-methylbutan-2-yl]propanamide

Drug info:

PubChemData

Smile

CCN1C=C(C2=CC=CC=C21)[C@@H](CC(=O)N[C@H](C)C(C)C)C3=CC(=CC=C3)F

DOS

IR

Vibrations