Geometry & MOs

Info

ID:	390991
PubChem CID:	135002068
Reduced:	NO4C17H21 (1)
Stoich.:	AB4C17D21 (1)
Weight, g/mol:	435.08339
ΔH_f, kcal/mol:	-115.95
Dipole, Da:	4.41
IP(EA), eV:	-8.85(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromophenyl)-N-tert-butyl-3-phenoxy-2-benzofuran-1-imine

Drug info:

PubChemData

Smile

CC(C)(C)N=C1C(=CC2=C1C=C(C=C2OC)OC)C(=O)OC

DOS

IR

Vibrations