Geometry & MOs

Info

ID:	299155
PubChem CID:	117673460
Reduced:	ON5C20H29 (1)
Stoich.:	AB5C20D29 (1)
Weight, g/mol:	427.251129
ΔH_f, kcal/mol:	-2.92
Dipole, Da:	0.16
IP(EA), eV:	-8.66(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,6E)-7-[4-[2-(dimethylamino)ethoxy]phenyl]-5,7-diphenylhepta-3,6-dien-1-ol

Drug info:

PubChemData

Smile

CC(C)CN1C(=O)CCC2=C1C=CC(=C2)C3=C(C=NN3)CN(C)CCN

DOS

IR

Vibrations