Geometry & MOs

Info

ID:	288685
PubChem CID:	104323570
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	296.133634
ΔH_f, kcal/mol:	-84.99
Dipole, Da:	4.36
IP(EA), eV:	-8.43(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,5-difluoro-4-(methylamino)phenyl]-(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N2CC3CCC(C3C2)O)NC

DOS

IR

Vibrations