Geometry & MOs

Info

ID:	416705
PubChem CID:	135090137
Reduced:	OSN5C16H19 (1)
Stoich.:	ABC5D16E19 (1)
Weight, g/mol:	317.199094
ΔH_f, kcal/mol:	13.69
Dipole, Da:	3.92
IP(EA), eV:	-9.15(-0.81)
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-(3-methylphenoxy)ethanone

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations