Geometry & MOs

Info

ID:	246415
PubChem CID:	103059574
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	197.098669
ΔH_f, kcal/mol:	-107.54
Dipole, Da:	4.58
IP(EA), eV:	-8.7(2.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(tert-butylsulfanylmethyl)pyrazin-2-amine

Drug info:

PubChemData

Smile

C1CCN(C(C1)CO)CC2COCCC2N

DOS

IR

Vibrations