Geometry & MOs

Info

ID:	209802
PubChem CID:	80724521
Reduced:	O3N4C11H12 (1)
Stoich.:	A3B4C11D12 (1)
Weight, g/mol:	286.168128
ΔH_f, kcal/mol:	8.07
Dipole, Da:	2.39
IP(EA), eV:	-9.26(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethoxy-3-N-[(2-methoxyphenyl)methyl]-3-N-methylbenzene-1,3-diamine

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)[N+](=O)[O-])NCC2=NC=CN2

DOS

IR

Vibrations