Geometry & MOs

Info

ID:	264897
PubChem CID:	103501672
Reduced:	NOC19H27 (1)
Stoich.:	ABC19D27 (1)
Weight, g/mol:	289.195426
ΔH_f, kcal/mol:	-6.4
Dipole, Da:	2.01
IP(EA), eV:	-8.72(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(6-fluoro-2,3-dihydroindol-1-yl)-2-methyl-2-(propan-2-ylamino)pentanenitrile

Drug info:

PubChemData

Smile

CC(C)C1CCN(CC1)CC2=CC(=CC=C2)C#CCCO

DOS

IR

Vibrations