Geometry & MOs

Info

ID:	204126
PubChem CID:	79916566
Reduced:	OSN2C16H26 (1)
Stoich.:	ABC2D16E26 (1)
Weight, g/mol:	289.215413
ΔH_f, kcal/mol:	-53.8
Dipole, Da:	2.51
IP(EA), eV:	-9.1(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCCC(C1)(C2=NC3=C(S2)C(OC3(C)C)(C)C)N

DOS

IR

Vibrations