Geometry & MOs

Info

ID:	219770
PubChem CID:	85164879
Reduced:	N3O9C31H37 (1)
Stoich.:	A3B9C31D37 (1)
Weight, g/mol:	595.210721
ΔH_f, kcal/mol:	-334.47
Dipole, Da:	8.77
IP(EA), eV:	-9.59(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]prop-2-enoxyimino]acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)CCCN(C(C(=O)O)C(=O)OC(C)(C)C)C(=O)C(=CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=N)N)C

DOS

IR

Vibrations