Geometry & MOs

Info

ID:	201489
PubChem CID:	79544666
Reduced:	FOSN2H11C13 (1)
Stoich.:	ABCD2E11F13 (1)
Weight, g/mol:	291.176919
ΔH_f, kcal/mol:	-8.36
Dipole, Da:	5.62
IP(EA), eV:	-9.68(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3-[cyclohexyl(methyl)amino]propylamino]methyl]thiophene-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CCOC2=CC(=C(C=C2)C#N)F

DOS

IR

Vibrations