Geometry & MOs

Info

ID:	204215
PubChem CID:	79932360
Reduced:	BrN3C16H24 (1)
Stoich.:	AB3C16D24 (1)
Weight, g/mol:	273.220498
ΔH_f, kcal/mol:	8.55
Dipole, Da:	3.13
IP(EA), eV:	-8.62(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)phenyl]-N-methylethanamine

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=C(C=C1)N2CCN3CCCCC3C2)Br)N

DOS

IR

Vibrations