Geometry & MOs

Info

ID:	124543
PubChem CID:	50887162
Reduced:	N2O5C17H18 (1)
Stoich.:	A2B5C17D18 (1)
Weight, g/mol:	397.01749
ΔH_f, kcal/mol:	-63.07
Dipole, Da:	6.11
IP(EA), eV:	-8.73(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylideneamino]phenol

Drug info:

PubChemData

Smile

CCOC1=CC(=CC(=C1OCC)[N+](=O)[O-])C=NC2=CC=C(C=C2)O

DOS

IR

Vibrations