Geometry & MOs

Info

ID:	256917
PubChem CID:	103142380
Reduced:	F3N3C15H20 (1)
Stoich.:	A3B3C15D20 (1)
Weight, g/mol:	233.108565
ΔH_f, kcal/mol:	-135.19
Dipole, Da:	4.31
IP(EA), eV:	-8.86(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-methyloxolan-2-yl)methyl]-1,1-dioxothiolan-3-amine

Drug info:

PubChemData

Smile

C1CNCC2=C1C=CC=C2N3CCN(CC3)CC(F)(F)F

DOS

IR

Vibrations