Geometry & MOs

Info

ID:	60082
PubChem CID:	26675659
Reduced:	N2O3H20C23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	432.148535
ΔH_f, kcal/mol:	34.61
Dipole, Da:	2.76
IP(EA), eV:	-8.48(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]-1-(4-methoxy-3-phenylmethoxyphenyl)methanimine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=N\OCC2=CC=CC=C2C#N)OCC3=CC=CC=C3

DOS

IR

Vibrations