Geometry & MOs

Info

ID:	165108
PubChem CID:	74501087
Reduced:	FN3C22H28 (1)
Stoich.:	AB3C22D28 (1)
Weight, g/mol:	344.133634
ΔH_f, kcal/mol:	2.55
Dipole, Da:	3.73
IP(EA), eV:	-8.64(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-fluoro-4-methoxyphenyl)methyl]-2-(2-fluorophenyl)-2,5-diazabicyclo[2.2.1]heptan-3-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2CCC(CC2)C3C(CNN3)C4=CC(=CC=C4)F

DOS

IR

Vibrations