Geometry & MOs

Info

ID:	362194
PubChem CID:	127307207
Reduced:	FO2N4C21H27 (1)
Stoich.:	AB2C4D21E27 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	-94.72
Dipole, Da:	4.03
IP(EA), eV:	-9.04(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)NC(=O)N2C3CCC2CC(C3)O)C4=CC=C(C=C4)F

DOS

IR

Vibrations