Geometry & MOs

Info

ID:	420398
PubChem CID:	135112944
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	352.179835
ΔH_f, kcal/mol:	-45.34
Dipole, Da:	5.83
IP(EA), eV:	-9.07(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[(4R,5S)-5-hydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=NO1)CNC2=NC=C(C=C2)C(=O)N3CCOCC3

DOS

IR

Vibrations