Geometry & MOs

Info

ID:	360183
PubChem CID:	127300826
Reduced:	O3N4C21H38 (1)
Stoich.:	A3B4C21D38 (1)
Weight, g/mol:	373.203528
ΔH_f, kcal/mol:	-158.37
Dipole, Da:	0.84
IP(EA), eV:	-8.49(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,1-dioxothiolan-3-yl)-[4-[(4-propan-2-ylmorpholin-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CCC(=O)N1CCCCC1C(=O)N2CCN(CC2)CC3CN(CCO3)C(C)C

DOS

IR

Vibrations