Geometry & MOs

Info

ID:	438008
PubChem CID:	135227461
Reduced:	FC3H4 (2)
Stoich.:	AB3C4 (2)
Weight, g/mol:	336.277678
ΔH_f, kcal/mol:	-90.38
Dipole, Da:	0.0
IP(EA), eV:	-9.06(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-3-ethylcyclopropyl)-1-(3-hydroxy-5,6,8a-trimethyl-2,3,3a,4,5,6,7,8-octahydro-1H-cyclohepta[b]pyrrol-2-yl)propan-2-one

Drug info:

PubChemData

Smile

C/C(=C\C=C(\F)/C)/F

DOS

IR

Vibrations