Geometry & MOs

Info

ID:	420545
PubChem CID:	135113772
Reduced:	S2N4O4C13H18 (1)
Stoich.:	A2B4C4D13E18 (1)
Weight, g/mol:	344.246378
ΔH_f, kcal/mol:	-80.09
Dipole, Da:	5.27
IP(EA), eV:	-9.82(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-2-[methyl-[(4-methylphenyl)methyl]amino]ethanone

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=N1)CCNC(=O)CNS(=O)(=O)C2=CC=CS2

DOS

IR

Vibrations