Geometry & MOs

Info

ID:	435741
PubChem CID:	135192287
Reduced:	O2N7C18H21 (1)
Stoich.:	A2B7C18D21 (1)
Weight, g/mol:	473.265157
ΔH_f, kcal/mol:	36.17
Dipole, Da:	3.87
IP(EA), eV:	-8.39(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(6-amino-5-methylpyrazin-2-yl)-2-methyl-N-[4-[4-(oxetan-3-yl)piperazin-1-yl]phenyl]-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine

Drug info:

PubChemData

Smile

CC1=NC=C(N=C1N)C2=CN3C=CN=C3C(=N2)NC(=C)/C=C(\C)/OCCO

DOS

IR

Vibrations