Geometry & MOs

Info

ID:	378894
PubChem CID:	134224996
Reduced:	FC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	187.1361
ΔH_f, kcal/mol:	-50.2
Dipole, Da:	3.02
IP(EA), eV:	-9.62(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7aS)-6-but-1-en-2-yl-5-methyl-7,7a-dihydro-1H-indole

Drug info:

PubChemData

Smile

C1[C@H]2CC(C1C=C2)CC3=CC(=C(C=C3)F)F

DOS

IR

Vibrations