Geometry & MOs

Info

ID:	210217
PubChem CID:	80774989
Reduced:	N4C17H30 (1)
Stoich.:	A4B17C30 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	-5.49
Dipole, Da:	3.44
IP(EA), eV:	-8.4(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,3-N-diethyl-3-N-methyl-2-nitrobenzene-1,3-diamine

Drug info:

PubChemData

Smile

CCCC1=C(N=CN=C1N(CC)C2CCCC2)NCCC

DOS

IR

Vibrations