Geometry & MOs

Info

ID:	418534
PubChem CID:	135105564
Reduced:	N2O4C25H30 (1)
Stoich.:	A2B4C25D30 (1)
Weight, g/mol:	388.191069
ΔH_f, kcal/mol:	-147.27
Dipole, Da:	2.9
IP(EA), eV:	-8.94(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,5S)-8-amino-3-azabicyclo[3.2.1]octan-3-yl]-[3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-1,2-oxazol-4-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CC=CC(=C1)C(=O)N2CCC3(CC2)C4=C(CCO3)C=C(C=C4)OC

DOS

IR

Vibrations