Geometry & MOs

Info

ID:	401788
PubChem CID:	135052575
Reduced:	SeN3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	263.95686
ΔH_f, kcal/mol:	63.68
Dipole, Da:	3.39
IP(EA), eV:	-8.65(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxy-2-selenocyanatophenyl)azanium;chloride

Drug info:

PubChemData

Smile

CCCNC1=NN=C(C([Se]1)C)C2=CC=CC=C2

DOS

IR

Vibrations