Geometry & MOs

Info

ID:	295478
PubChem CID:	117530390
Reduced:	O3N4C12H16 (1)
Stoich.:	A3B4C12D16 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	-34.63
Dipole, Da:	4.08
IP(EA), eV:	-8.8(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(3-methoxyphenyl)-N,N'-dimethylethane-1,2-diamine

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)CN2C=NC(=N2)N

DOS

IR

Vibrations