Geometry & MOs

Info

ID:	305757
PubChem CID:	124968194
Reduced:	O2N5C17H17 (1)
Stoich.:	A2B5C17D17 (1)
Weight, g/mol:	334.165443
ΔH_f, kcal/mol:	18.25
Dipole, Da:	5.29
IP(EA), eV:	-9.25(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pyrazin-2-yl-3-[(3R)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)[C@H]2CN(CCO2)C(=O)C3=NNC4=CC=CC=C43

DOS

IR

Vibrations