Geometry & MOs

Info

ID:	179553
PubChem CID:	76496948
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	489.20394
ΔH_f, kcal/mol:	-95.96
Dipole, Da:	5.69
IP(EA), eV:	-9.04(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(4-fluorophenyl)-3-[2-methoxy-5-[2-(trifluoromethyl)imidazol-1-yl]phenyl]-N-methyl-1-oxaspiro[4.4]nonan-8-amine

Drug info:

PubChemData

Smile

CC(C1=C2C=CC(=CC2=C(C=C1)CO)CN)(C(=O)O)N

DOS

IR

Vibrations