Geometry & MOs

Info

ID:	230753
PubChem CID:	87571885
Reduced:	ClO2N4C21H27 (1)
Stoich.:	AB2C4D21E27 (1)
Weight, g/mol:	290.088338
ΔH_f, kcal/mol:	-49.34
Dipole, Da:	9.41
IP(EA), eV:	-8.15(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-3-diethoxyphosphorylprop-1-enyl]-1,4-difluorobenzene

Drug info:

PubChemData

Smile

CC(C)(C)C(C1(CC1)CNC2=CC(=C(N=C2)Cl)C3=CC=C(C=C3)N)NC(=O)O

DOS

IR

Vibrations