Geometry & MOs

Info

ID:	445743
PubChem CID:	135269287
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	301.215413
ΔH_f, kcal/mol:	-107.11
Dipole, Da:	5.54
IP(EA), eV:	-8.82(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E)-1-N'-ethenyl-1-N,3-N-dimethyl-2-(3-methylphenoxy)-3-N-propylbuta-1,3-diene-1,1,3-triamine

Drug info:

PubChemData

Smile

CN1C2=C(CC(C(=N2)OC3=CC=C(C=C3)N)CC4=CC=CC=C4)C(=O)N(C1=O)CCCO

DOS

IR

Vibrations