Geometry & MOs

Info

ID:	47028
PubChem CID:	10529021
Reduced:	SiO8C25H32 (1)
Stoich.:	AB8C25D32 (1)
Weight, g/mol:	488.267508
ΔH_f, kcal/mol:	-340.47
Dipole, Da:	3.0
IP(EA), eV:	-9.96(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (4E)-4-[cyclohexyl-[4-(quinolin-2-ylmethoxy)phenyl]methoxy]iminopentanoate

Drug info:

PubChemData

Smile

C[Si](C)(C)CCO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

DOS

IR

Vibrations