Geometry & MOs

Info

ID:	327502
PubChem CID:	126690152
Reduced:	O2S2F4N7H25C27 (1)
Stoich.:	A2B2C4D7E25F27 (1)
Weight, g/mol:	284.173607
ΔH_f, kcal/mol:	-113.91
Dipole, Da:	8.72
IP(EA), eV:	-8.69(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylhexan-2-yl 2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate

Drug info:

PubChemData

Smile

CN(C1=C(N=C2N1N=C(C=C2)C3CCN(CC3)S(=O)C)CCC#N)C4=NC(=C(S4)C(=O)C(F)(F)F)C5=CC=C(C=C5)F

DOS

IR

Vibrations