Geometry & MOs

Info

ID:	263050
PubChem CID:	103336904
Reduced:	O2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	282.124739
ΔH_f, kcal/mol:	-34.53
Dipole, Da:	6.66
IP(EA), eV:	-7.98(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-chloropyrazin-2-yl)-[4-(2-methylpropyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)CNC(=O)C2=CNC=CC2=O

DOS

IR

Vibrations