Geometry & MOs

Info

ID:	377938
PubChem CID:	134224005
Reduced:	BrNO2H14C20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	416.282764
ΔH_f, kcal/mol:	32.36
Dipole, Da:	4.12
IP(EA), eV:	-8.96(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z,4S,6S)-5-[[(Z)-3-amino-1,3-diphenylprop-2-enylidene]amino]-4,6,7-trimethyldeca-2,9-dien-4-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4O3

DOS

IR

Vibrations