Geometry & MOs

Info

ID:	425481
PubChem CID:	135126475
Reduced:	SF2N3O5C13H13 (1)
Stoich.:	AB2C3D5E13F13 (1)
Weight, g/mol:	421.01072
ΔH_f, kcal/mol:	-240.06
Dipole, Da:	6.09
IP(EA), eV:	-10.07(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[8-(5-bromo-2-fluorophenyl)-4,4-dihydroxy-5,8-dimethyl-4lambda4-thia-5,7-diazaspiro[2.5]oct-6-en-6-yl]carbamic acid

Drug info:

PubChemData

Smile

CC1(CS(=O)(=O)N(C(=N1)NC(=O)O)C)C2=C(C(=CC(=C2)C=O)F)F

DOS

IR

Vibrations