Geometry & MOs

Info

ID:	199517
PubChem CID:	79258944
Reduced:	F3N3O3C11H18 (1)
Stoich.:	A3B3C3D11E18 (1)
Weight, g/mol:	263.064383
ΔH_f, kcal/mol:	-288.63
Dipole, Da:	3.82
IP(EA), eV:	-9.01(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-N-[(2-chloro-4-fluorophenyl)methyl]-3-methylbutan-2-amine

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CN(CC(=O)O)CC(F)(F)F

DOS

IR

Vibrations