Geometry & MOs

Info

ID:	423889
PubChem CID:	135120639
Reduced:	FN5O5C32H38 (1)
Stoich.:	AB5C5D32E38 (1)
Weight, g/mol:	391.154349
ΔH_f, kcal/mol:	-195.69
Dipole, Da:	3.55
IP(EA), eV:	-9.25(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-fluoro-3-methoxyphenyl)-3-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C2C=CC(=C1)C(=O)NCCCN(CCCC(=O)NCC3=CC(=CC(=C3)F)O2)C(=O)C4=C(NN=C4)C5CCCCC5

DOS

IR

Vibrations