Geometry & MOs

Info

ID:	420333
PubChem CID:	135112553
Reduced:	NSO4C13H23 (1)
Stoich.:	ABC4D13E23 (1)
Weight, g/mol:	357.266779
ΔH_f, kcal/mol:	-206.34
Dipole, Da:	4.35
IP(EA), eV:	-9.52(0.8)
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]-4-(4-propan-2-ylphenyl)butan-1-one

Drug info:

PubChemData

Smile

CS(=O)(=O)CCC(=O)N1CCC[C@]2(C1)CCC[C@H]2O

DOS

IR

Vibrations