Geometry & MOs

Info

ID:	391086
PubChem CID:	135002714
Reduced:	N3O7C23H29 (1)
Stoich.:	A3B7C23D29 (1)
Weight, g/mol:	393.154035
ΔH_f, kcal/mol:	-256.3
Dipole, Da:	9.02
IP(EA), eV:	-8.99(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-5,6-difluoro-3-phenoxy-3-phenyl-2-benzofuran-1-imine

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)N(C1CCCCC1)C2=C(C(N3C=CC=C(C3=N2)C)C(=O)OC)C(=O)OC

DOS

IR

Vibrations