Geometry & MOs

Info

ID:	24229
PubChem CID:	608543
Reduced:	NPO4H20C22 (1)
Stoich.:	ABC4D20E22 (1)
Weight, g/mol:	393.112995
ΔH_f, kcal/mol:	-55.52
Dipole, Da:	6.23
IP(EA), eV:	-9.42(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-diphenylphosphoryloxy-2-methylprop-1-enyl)-3-nitrobenzene

Drug info:

PubChemData

Smile

CC(=C(C1=CC(=CC=C1)[N+](=O)[O-])OP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)C

DOS

IR

Vibrations