Geometry & MOs

Info

ID:	167832
PubChem CID:	74883828
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	284.048318
ΔH_f, kcal/mol:	-49.19
Dipole, Da:	4.16
IP(EA), eV:	-9.1(0.18)
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-(2,6-dichlorophenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C(=O)N2CCC3C2CNC3)C

DOS

IR

Vibrations