Geometry & MOs

Info

ID:	286680
PubChem CID:	104179691
Reduced:	FNC16H22 (1)
Stoich.:	ABC16D22 (1)
Weight, g/mol:	259.106457
ΔH_f, kcal/mol:	-15.97
Dipole, Da:	2.49
IP(EA), eV:	-8.95(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethylsulfanylpropylamino)-2-thiophen-3-ylpropan-2-ol

Drug info:

PubChemData

Smile

C1CC1CCCNC2CC(C2)C3=CC=CC=C3F

DOS

IR

Vibrations