Geometry & MOs

Info

ID:	124499
PubChem CID:	50885367
Reduced:	O12H28C29 (1)
Stoich.:	A12B28C29 (1)
Weight, g/mol:	458.93309
ΔH_f, kcal/mol:	-411.32
Dipole, Da:	7.46
IP(EA), eV:	-8.91(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-4-ethoxy-5-methoxyphenyl)-N-(2-iodophenyl)methanimine

Drug info:

PubChemData

Smile

CC1(OC(=O)C(=CC2=CC(=C(C=C2)OCOC3=C(C=C(C=C3)C=C4C(=O)OC(OC4=O)(C)C)OC)OC)C(=O)O1)C

DOS

IR

Vibrations