Geometry & MOs

Info

ID:	184684
PubChem CID:	77192920
Reduced:	O9C21H34 (1)
Stoich.:	A9B21C34 (1)
Weight, g/mol:	551.318815
ΔH_f, kcal/mol:	-381.58
Dipole, Da:	4.08
IP(EA), eV:	-9.06(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxyphenyl)-4-[2-[4-(3-methylhexan-3-yl)phenyl]-2-phenylethenyl]-N-phenylaniline

Drug info:

PubChemData

Smile

CCC1C(C(C(C(O1)OCC(=CCC2C(C(=O)C(=C(C2O)OC)OC)C)C)O)O)O

DOS

IR

Vibrations