Geometry & MOs

Info

ID:	444744
PubChem CID:	135263410
Reduced:	FO2C16H19 (1)
Stoich.:	AB2C16D19 (1)
Weight, g/mol:	577.297428
ΔH_f, kcal/mol:	-108.93
Dipole, Da:	3.65
IP(EA), eV:	-9.79(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[2-(4-methyl-2-piperidin-1-ylphenyl)ethyl]furan-2-yl]methyl]-2-[4-(4-methylsulfonylpiperidin-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CCCCCC(=CC1=CC=C(C=C1)F)/C=C/C(=O)O

DOS

IR

Vibrations