Geometry & MOs

Info

ID:	167811
PubChem CID:	74881915
Reduced:	N2O2F5H11C12 (1)
Stoich.:	A2B2C5D11E12 (1)
Weight, g/mol:	306.079154
ΔH_f, kcal/mol:	-278.05
Dipole, Da:	1.94
IP(EA), eV:	-9.54(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrol-1-yl-(2,3,4,5,6-pentafluorophenyl)methanone

Drug info:

PubChemData

Smile

COC1CNCC1NC(=O)C2=C(C(=C(C(=C2F)F)F)F)F

DOS

IR

Vibrations