Geometry & MOs

Info

ID:	445892
PubChem CID:	135269879
Reduced:	N7C18H19 (1)
Stoich.:	A7B18C19 (1)
Weight, g/mol:	428.196074
ΔH_f, kcal/mol:	149.45
Dipole, Da:	1.74
IP(EA), eV:	-8.88(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzenecarboximidoyl 3-methyl-6-[4-(piperazine-1-carbonyl)phenyl]pyrazine-2-carboximidate

Drug info:

PubChemData

Smile

C=NNC(=NCC1=NC(=CN=C1N)C2=CN=CC=C2)C3=CC=CCC3

DOS

IR

Vibrations