Geometry & MOs

Info

ID:	378493
PubChem CID:	134224579
Reduced:	SN2O3C21H24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	485.279075
ΔH_f, kcal/mol:	-22.28
Dipole, Da:	5.64
IP(EA), eV:	-9.04(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,6-dimethyl-3-bicyclo[3.2.2]nonanyl)-2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxyphenyl]imidazo[1,2-a]pyrazin-3-amine

Drug info:

PubChemData

Smile

C/C=C(\C=C/C(=C)[C@@H]1[C@H](C1(C)C)C2=CN=C(O2)C3=CC=CC=C3)/S(=O)(=O)N

DOS

IR

Vibrations