Geometry & MOs

Info

ID:	260336
PubChem CID:	103188878
Reduced:	SN4C10H20 (1)
Stoich.:	AB4C10D20 (1)
Weight, g/mol:	289.215413
ΔH_f, kcal/mol:	40.68
Dipole, Da:	5.93
IP(EA), eV:	-9.08(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[1-(dimethylamino)propan-2-yl-ethylamino]propoxy]benzonitrile

Drug info:

PubChemData

Smile

CCN(C(C)CN(C)C)C(=NC#N)SC

DOS

IR

Vibrations