Geometry & MOs

Info

ID:	172191
PubChem CID:	75476931
Reduced:	BrFNO3C14H15 (1)
Stoich.:	ABCD3E14F15 (1)
Weight, g/mol:	328.105705
ΔH_f, kcal/mol:	-123.76
Dipole, Da:	0.33
IP(EA), eV:	-9.8(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-difluoro-4-methylsulfanylphenyl)-5-oxa-8-azaspiro[3.5]nonane-8-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=C(C(=CC(=C1)Br)F)OCC(=O)NCC2CC2

DOS

IR

Vibrations