Geometry & MOs

Info

ID:	290325
PubChem CID:	104429627
Reduced:	O3N4C13H20 (1)
Stoich.:	A3B4C13D20 (1)
Weight, g/mol:	295.128054
ΔH_f, kcal/mol:	-108.98
Dipole, Da:	4.1
IP(EA), eV:	-8.66(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(ethylamino)-3-oxopropyl]-3-hydrazinyl-4-nitrobenzamide

Drug info:

PubChemData

Smile

CNC1=C(C=CC=N1)C(=O)NCCC(=O)NCCOC

DOS

IR

Vibrations