Geometry & MOs

Info

ID:	360182
PubChem CID:	127300825
Reduced:	O3N4C20H36 (1)
Stoich.:	A3B4C20D36 (1)
Weight, g/mol:	394.294391
ΔH_f, kcal/mol:	-153.76
Dipole, Da:	9.15
IP(EA), eV:	-8.62(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[(4-propan-2-ylmorpholin-2-yl)methyl]piperazine-1-carbonyl]piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C)N1CCOC(C1)CN2CCN(CC2)C(=O)C3CCCN(C3)C(=O)C

DOS

IR

Vibrations