Geometry & MOs

Info

ID:	390154
PubChem CID:	134997406
Reduced:	N2O3H18C22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	382.19539
ΔH_f, kcal/mol:	109.42
Dipole, Da:	4.52
IP(EA), eV:	-9.4(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3E,7aR)-3-[1-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpropylidene]-7-methyl-7aH-[1,2,4]diazaphospholo[4,3-c]diazaphosphol-5-yl]ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN(C(C#CC2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-])O

DOS

IR

Vibrations