Geometry & MOs

Info

ID:	434060
PubChem CID:	135174217
Reduced:	BrClON3C24H29 (1)
Stoich.:	ABCD3E24F29 (1)
Weight, g/mol:	147.104799
ΔH_f, kcal/mol:	45.36
Dipole, Da:	3.04
IP(EA), eV:	-8.93(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-N-[(1Z)-buta-1,3-dienyl]hexa-1,4-dien-3-imine

Drug info:

PubChemData

Smile

C=CCOC1=CC(=CC(=C1)/C=C/C2=C(C=C(C=C2)Cl)Br)CNCCNCC3CNC3

DOS

IR

Vibrations