Geometry & MOs

Info

ID:	37126
PubChem CID:	8017197
Reduced:	BrFON3C19H23 (1)
Stoich.:	ABCD3E19F23 (1)
Weight, g/mol:	407.184506
ΔH_f, kcal/mol:	45.73
Dipole, Da:	16.09
IP(EA), eV:	-5.16(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5S,6R)-6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]-N-(4-phenoxyphenyl)acetamide

Drug info:

PubChemData

Smile

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(=O)NC3=C(C=C(C=C3)Br)F

DOS

IR

Vibrations