Geometry & MOs

Info

ID:	151279
PubChem CID:	53790979
Reduced:	ClNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	448.366493
ΔH_f, kcal/mol:	-64.96
Dipole, Da:	2.43
IP(EA), eV:	-8.96(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(3-dodecyl-2,5-dihydroxypyrrol-1-yl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(=CC1=CC=CC=C1)N(CCOC)C(=O)CCl

DOS

IR

Vibrations