Geometry & MOs

Info

ID:	211745
PubChem CID:	81053117
Reduced:	ClO2N3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	264.220164
ΔH_f, kcal/mol:	-77.77
Dipole, Da:	7.22
IP(EA), eV:	-8.51(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(2-ethoxyethyl)-1-N-methyl-1-(2-methylphenyl)butane-1,2-diamine

Drug info:

PubChemData

Smile

CCOCCN(C)CC(=O)NC1=C(C=C(C=C1)Cl)N

DOS

IR

Vibrations