Geometry & MOs

Info

ID:	210321
PubChem CID:	80788259
Reduced:	ON3C5H9 (2)
Stoich.:	AB3C5D9 (2)
Weight, g/mol:	266.13789
ΔH_f, kcal/mol:	-55.57
Dipole, Da:	2.49
IP(EA), eV:	-9.38(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-(ethylamino)-5-nitroanilino]ethyl]acetamide

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)OC)NCCNC(=O)C

DOS

IR

Vibrations