Geometry & MOs

Info

ID:	14236
PubChem CID:	407019
Reduced:	SN2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	234.11907
ΔH_f, kcal/mol:	36.39
Dipole, Da:	7.21
IP(EA), eV:	-8.49(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(dipropylamino)phenyl] thiocyanate

Drug info:

PubChemData

Smile

CCCN(CCC)C1=CC=C(C=C1)SC#N

DOS

IR

Vibrations