Geometry & MOs

Info

ID:	381599
PubChem CID:	134972384
Reduced:	NSO4H21C24 (1)
Stoich.:	ABC4D21E24 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-66.01
Dipole, Da:	7.41
IP(EA), eV:	-8.22(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(4-methoxyphenyl)methyl]-1,3,3-trimethylpiperidin-4-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2/C(=C/C4=CC=C(C=C4)OC)/O

DOS

IR

Vibrations