Geometry & MOs

Info

ID:	419944
PubChem CID:	135109984
Reduced:	NO2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	381.194008
ΔH_f, kcal/mol:	-212.24
Dipole, Da:	3.53
IP(EA), eV:	-8.85(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4R,5R)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-[4-(4-methoxyphenoxy)phenyl]methanone

Drug info:

PubChemData

Smile

C[C@]1(CCOC2([C@H]1O)CCN(CC2)C(=O)CN3CCCCCC3)O

DOS

IR

Vibrations