Geometry & MOs

Info

ID:	391018
PubChem CID:	135002258
Reduced:	N3O7C32H41 (1)
Stoich.:	A3B7C32D41 (1)
Weight, g/mol:	357.172879
ΔH_f, kcal/mol:	-271.9
Dipole, Da:	1.46
IP(EA), eV:	-8.57(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-3-phenoxy-3-phenyl-2-benzofuran-1-imine

Drug info:

PubChemData

Smile

C[C@H](C(C(=O)NC1=CCCCC1)N(C)C(=O)CC[C@H](C(=O)OC)NC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations