Geometry & MOs

Info

ID:	362041
PubChem CID:	127305578
Reduced:	FO2N3C18H22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	329.173942
ΔH_f, kcal/mol:	-117.37
Dipole, Da:	5.57
IP(EA), eV:	-9.06(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.2]octan-3-yl)-N-methyl-2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetamide

Drug info:

PubChemData

Smile

CN(C1CN2CCC1CC2)C(=O)C3CC(=O)NC4=C3C=CC(=C4)F

DOS

IR

Vibrations