Geometry & MOs

Info

ID:	362747
PubChem CID:	127309292
Reduced:	O3N5C16H27 (1)
Stoich.:	A3B5C16D27 (1)
Weight, g/mol:	364.196234
ΔH_f, kcal/mol:	-79.98
Dipole, Da:	4.75
IP(EA), eV:	-9.35(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2,6-difluorophenyl)cyclopentyl]methyl]-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C(C)N2CCN(CC2)C(=O)NCC3CCOCC3

DOS

IR

Vibrations