Geometry & MOs

Info

ID:	124569
PubChem CID:	50887781
Reduced:	O3N6H24C26 (1)
Stoich.:	A3B6C24D26 (1)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	34.18
Dipole, Da:	12.27
IP(EA), eV:	-9.05(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2E)-2-[(3-methoxy-2-prop-2-enoxyphenyl)methylidene]hydrazinyl]benzoic acid

Drug info:

PubChemData

Smile

CC\1=C(C(=O)N(C(=O)/C1=N/NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)CCC4=CC=CC=C4)C#N

DOS

IR

Vibrations