Geometry & MOs

Info

ID:	314328
PubChem CID:	126621381
Reduced:	N2C7H17 (2)
Stoich.:	A2B7C17 (2)
Weight, g/mol:	440.122688
ΔH_f, kcal/mol:	-33.77
Dipole, Da:	0.13
IP(EA), eV:	-8.89(2.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[4-chloro-2-(trifluoromethyl)phenyl]-4-(6-methoxy-5-methylpyridin-2-yl)-6,7,9,9a-tetrahydro-1H-pyrazino[1,2-d][1,2,4]oxadiazine

Drug info:

PubChemData

Smile

CC(C)CCNCCNCCNCCNC(C)C

DOS

IR

Vibrations