Geometry & MOs

Info

ID:	251758
PubChem CID:	103106704
Reduced:	O3N5C12H15 (1)
Stoich.:	A3B5C12D15 (1)
Weight, g/mol:	292.189926
ΔH_f, kcal/mol:	8.08
Dipole, Da:	4.58
IP(EA), eV:	-10.33(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-ethyl-3-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(N=N1)CC2=NC(=NO2)C)C3CC3

DOS

IR

Vibrations