Geometry & MOs

Info

ID:	426317
PubChem CID:	135143345
Reduced:	ON2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	129.095378
ΔH_f, kcal/mol:	-71.04
Dipole, Da:	3.59
IP(EA), eV:	-9.49(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-fluoroethyl)-3,3-dimethyl-2H-azete

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(N1C(=O)NC)C(C)(C)C)C)C2=CN=CC=C2

DOS

IR

Vibrations