Geometry & MOs

Info

ID:	229788
PubChem CID:	87569027
Reduced:	N2O2H8C11 (2)
Stoich.:	A2B2C8D11 (2)
Weight, g/mol:	477.215138
ΔH_f, kcal/mol:	11.21
Dipole, Da:	16.28
IP(EA), eV:	-8.94(-2.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-3-[4-[2-hydroxy-3-[(2-methoxy-2-phenoxyethyl)amino]propoxy]phenyl]-2-phenylprop-2-enoate

Drug info:

PubChemData

Smile

C1CN2C3=C(C=C(C=C3)C4=N/C(=C/5\C=CC(=O)C(=C5)C#N)/ON4)C=C2[C@@H]1CC(=O)O

DOS

IR

Vibrations