Geometry & MOs

Info

ID:	282218
PubChem CID:	103919012
Reduced:	NSO2F3C14H18 (1)
Stoich.:	ABC2D3E14F18 (1)
Weight, g/mol:	291.219829
ΔH_f, kcal/mol:	-246.04
Dipole, Da:	5.64
IP(EA), eV:	-9.9(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-butylphenyl)-N-(6-hydroxyhexyl)acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NCCCCCCO)SC(F)(F)F

DOS

IR

Vibrations