Geometry & MOs

Info

ID:	189217
PubChem CID:	77828041
Reduced:	O2F3N4C21H29 (1)
Stoich.:	A2B3C4D21E29 (1)
Weight, g/mol:	231.092915
ΔH_f, kcal/mol:	-244.19
Dipole, Da:	6.35
IP(EA), eV:	-9.34(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethyl-1,1-dioxo-3,3a,4,5,6,6a-hexahydrothieno[2,3-c]pyrrol-4-yl)ethanone

Drug info:

PubChemData

Smile

CN(C1CCC1)C(=O)C(C2CCC(CC2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F)N

DOS

IR

Vibrations