Geometry & MOs

Info

ID:	387053
PubChem CID:	134983795
Reduced:	N2O5C21H30 (1)
Stoich.:	A2B5C21D30 (1)
Weight, g/mol:	427.202629
ΔH_f, kcal/mol:	-135.5
Dipole, Da:	2.86
IP(EA), eV:	-9.37(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-ethenyl-1-[(E)-6-methoxy-5-nitro-6-oxohex-2-enyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CCCC(C(C)(C)[N+](=O)[O-])O)CC#CC1=CC=CC=C1

DOS

IR

Vibrations