Geometry & MOs

Info

ID:	210691
PubChem CID:	80841136
Reduced:	ON4C11H20 (1)
Stoich.:	AB4C11D20 (1)
Weight, g/mol:	196.132411
ΔH_f, kcal/mol:	-39.78
Dipole, Da:	3.38
IP(EA), eV:	-8.86(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[6-(methylamino)pyrazin-2-yl]amino]butan-2-ol

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC=N1)NCCC(C)O

DOS

IR

Vibrations