Geometry & MOs

Info

ID:	316110
PubChem CID:	126630090
Reduced:	N4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	621.303165
ΔH_f, kcal/mol:	68.51
Dipole, Da:	5.7
IP(EA), eV:	-8.19(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(E)-2-[4-[N-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]anilino]phenyl]ethenyl]phenyl]methanol

Drug info:

PubChemData

Smile

CCC#CC1=C(N(C2=C1N=C(N=C2N)C)C)C

DOS

IR

Vibrations