Geometry & MOs

Info

ID:	358375
PubChem CID:	127295920
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	343.192963
ΔH_f, kcal/mol:	-37.34
Dipole, Da:	2.13
IP(EA), eV:	-8.64(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothiolan-3-yl)-2-(3-piperidin-1-ylpyrrolidin-1-yl)propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C2=NOC(=N2)CN3CCC(C3)N4CCCCC4)OC

DOS

IR

Vibrations