Geometry & MOs

Info

ID:	433832
PubChem CID:	135173975
Reduced:	I2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	339.324963
ΔH_f, kcal/mol:	24.79
Dipole, Da:	1.15
IP(EA), eV:	-8.48(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-ethyl-4-(methoxymethyl)-2,4-dimethylhexyl]-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine

Drug info:

PubChemData

Smile

C1CN(CCC12CC(C2)N3CCN(CC3)I)I

DOS

IR

Vibrations