Geometry & MOs

Info

ID:	232893
PubChem CID:	87577443
Reduced:	ClO3N5C19H22 (1)
Stoich.:	AB3C5D19E22 (1)
Weight, g/mol:	198.044581
ΔH_f, kcal/mol:	-67.84
Dipole, Da:	8.24
IP(EA), eV:	-8.6(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-3-phenylprop-2-enyl] dihydrogen phosphite

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(N=C(N=C2Cl)N)N(C1)CC3=NC=C(C(=C3C)OC)C

DOS

IR

Vibrations