Geometry & MOs

Info

ID:	158974
PubChem CID:	57244334
Reduced:	NO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	449.152449
ΔH_f, kcal/mol:	-121.12
Dipole, Da:	2.08
IP(EA), eV:	-8.6(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[4-(3,3-dichloroprop-2-enoxy)-2,6-diethylphenoxy]propoxy]-1-phenylethenamine

Drug info:

PubChemData

Smile

CC1=C2CC(NC2=C(C=C1)C)(C(=O)OC)O

DOS

IR

Vibrations