Geometry & MOs

Info

ID:	356556
PubChem CID:	127291782
Reduced:	N3O4C18H29 (1)
Stoich.:	A3B4C18D29 (1)
Weight, g/mol:	392.278741
ΔH_f, kcal/mol:	-161.87
Dipole, Da:	2.76
IP(EA), eV:	-9.03(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethylmorpholin-4-yl)-1-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]-3-methylbutan-1-one

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)C(C)OCC3CCCO3)C

DOS

IR

Vibrations