Geometry & MOs

Info

ID:	275771
PubChem CID:	103817555
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	207.148396
ΔH_f, kcal/mol:	-119.27
Dipole, Da:	5.17
IP(EA), eV:	-9.0(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine

Drug info:

PubChemData

Smile

CCNC(=O)CN(CC)C1=NC=C(C=C1)C(=O)OCC

DOS

IR

Vibrations