Geometry & MOs

Info

ID:	38400
PubChem CID:	8035064
Reduced:	N2O4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	355.137729
ΔH_f, kcal/mol:	-131.5
Dipole, Da:	3.8
IP(EA), eV:	-8.69(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(3S)-3-(4-chlorophenyl)-3-(4-fluorophenyl)propyl]-(pyridin-2-ylmethyl)azanium

Drug info:

PubChemData

Smile

CC1=CC(=O)OC2=C1C=CC3=C2CN(CO3)CCCN4CCOCC4

DOS

IR

Vibrations