Geometry & MOs

Info

ID:	35869
PubChem CID:	7980424
Reduced:	N2O5C16H20 (1)
Stoich.:	A2B5C16D20 (1)
Weight, g/mol:	358.116486
ΔH_f, kcal/mol:	-189.19
Dipole, Da:	4.0
IP(EA), eV:	-9.0(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N)C(=O)COC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations