Geometry & MOs

Info

ID:	419469
PubChem CID:	135108250
Reduced:	SO2N4C18H18 (1)
Stoich.:	AB2C4D18E18 (1)
Weight, g/mol:	368.150285
ΔH_f, kcal/mol:	21.65
Dipole, Da:	4.7
IP(EA), eV:	-9.3(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-N-(3-chloro-4-methylphenyl)-4,5-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

Drug info:

PubChemData

Smile

C1COC2(CCN(CC2)C(=O)C3=CC4=NNN=C4C=C3)C5=C1SC=C5

DOS

IR

Vibrations