Geometry & MOs

Info

ID:	285084
PubChem CID:	104097126
Reduced:	N3O3C11H15 (1)
Stoich.:	A3B3C11D15 (1)
Weight, g/mol:	239.126991
ΔH_f, kcal/mol:	-78.8
Dipole, Da:	4.0
IP(EA), eV:	-9.44(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-(2-hydroxypentylamino)pyrazine-2-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CN=CC(=N1)NCC2(CCC2)O

DOS

IR

Vibrations