Geometry & MOs

Info

ID:	206781
PubChem CID:	80301051
Reduced:	SN3C8H11 (1)
Stoich.:	AB3C8D11 (1)
Weight, g/mol:	217.09636
ΔH_f, kcal/mol:	57.91
Dipole, Da:	4.79
IP(EA), eV:	-9.26(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-nitroso-[3-(pyridin-2-ylmethyl)-1H-imidazol-2-ylidene]methanamine

Drug info:

PubChemData

Smile

C1=CN(C(=N1)C#N)CCCCS

DOS

IR

Vibrations