Geometry & MOs

Info

ID:	421780
PubChem CID:	135116603
Reduced:	SO2N3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	361.225308
ΔH_f, kcal/mol:	-33.52
Dipole, Da:	1.85
IP(EA), eV:	-9.56(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-2-(2-methoxyphenoxy)-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CC1=NC=C2CCC3(C2=N1)CCCN(C3)C(=O)C4=CC=C(S4)C(=O)C

DOS

IR

Vibrations