Geometry & MOs

Info

ID:	10236
PubChem CID:	99203
Reduced:	OSN2C7H12 (1)
Stoich.:	ABC2D7E12 (1)
Weight, g/mol:	172.067034
ΔH_f, kcal/mol:	-20.4
Dipole, Da:	6.81
IP(EA), eV:	-9.6(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(diethylamino)-2-oxoethyl] thiocyanate

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CSC#N

DOS

IR

Vibrations