Geometry & MOs

Info

ID:	413736
PubChem CID:	135086686
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	318.117352
ΔH_f, kcal/mol:	-152.65
Dipole, Da:	2.07
IP(EA), eV:	-9.16(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-diphenylphosphorylethenyl)-2-methylbenzene

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC/C(=C\C2=CC=CO2)/C1=O

DOS

IR

Vibrations