Geometry & MOs

Info

ID:	328200
PubChem CID:	126697544
Reduced:	OC26H52 (1)
Stoich.:	AB26C52 (1)
Weight, g/mol:	329.192569
ΔH_f, kcal/mol:	-152.72
Dipole, Da:	2.25
IP(EA), eV:	-9.59(1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-(4-piperidin-1-ylbutyl)phenyl]-1,3-thiazol-5-yl]methanamine

Drug info:

PubChemData

Smile

CCCCCCCCC(CCCCCCCC)/C=C/CCCCCCCO

DOS

IR

Vibrations