Geometry & MOs

Info

ID:	393541
PubChem CID:	135020996
Reduced:	NC15H22 (2)
Stoich.:	AB15C22 (2)
Weight, g/mol:	480.325297
ΔH_f, kcal/mol:	46.22
Dipole, Da:	20.27
IP(EA), eV:	-5.5(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2E)-2-[(2Z,5R)-3,7-dimethyl-5-[3-[2-(methylamino)ethyl]-1H-indol-2-yl]octa-2,6-dienylidene]indol-3-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

CCC1C[N+]2(CCC1CC2)CC3=CC4=C(C=C3)C=CC(=C4)C[N+]56CCC(CC5)C(C6)CC

DOS

IR

Vibrations