Geometry & MOs

Info

ID:	340450
PubChem CID:	127262461
Reduced:	N2O3H12C14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	284.116092
ΔH_f, kcal/mol:	-37.56
Dipole, Da:	6.59
IP(EA), eV:	-8.94(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-methoxy-5-[(E)-(phenylhydrazinylidene)methyl]benzoate

Drug info:

PubChemData

Smile

COC(=O)C1=C/C(=C/NC2=CN=CC=C2)/C=CC1=O

DOS

IR

Vibrations