Geometry & MOs

Info

ID:	368714
PubChem CID:	127329923
Reduced:	O3N4C19H36 (1)
Stoich.:	A3B4C19D36 (1)
Weight, g/mol:	393.310376
ΔH_f, kcal/mol:	-155.57
Dipole, Da:	2.49
IP(EA), eV:	-8.51(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-4-[(4-propan-2-ylmorpholin-2-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1CCOC(C1)CN2CCN(CC2)C(=O)NC(C)C3CCCO3

DOS

IR

Vibrations