Geometry & MOs

Info

ID:	120764
PubChem CID:	50743760
Reduced:	FNO3H20C24 (1)
Stoich.:	ABC3D20E24 (1)
Weight, g/mol:	412.101227
ΔH_f, kcal/mol:	-73.86
Dipole, Da:	3.85
IP(EA), eV:	-8.86(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl)-[2-(4-methoxyphenyl)-3-sulfanylidene-1,4-diazaspiro[4.5]dec-1-en-4-yl]methanone

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CN2C(C(=C(C2=O)O)C3=CC=CC=C3)C4=CC=CC=C4F

DOS

IR

Vibrations