Geometry & MOs

Info

ID:	439004
PubChem CID:	135228766
Reduced:	NO2C29H33 (1)
Stoich.:	AB2C29D33 (1)
Weight, g/mol:	431.3552
ΔH_f, kcal/mol:	-40.67
Dipole, Da:	9.07
IP(EA), eV:	-8.54(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E)-2-[4-[(E,5Z)-5-ethylidene-4,6-dimethylidenenon-2-en-2-yl]-2-methyl-5-(2,3,3-trimethylbutyl)phenyl]buta-1,3-dien-1-amine

Drug info:

PubChemData

Smile

CCC1=C(C=C2CC(N3C=C(C(=O)C=C3C2=C1)C(=C)C)C(C)(C)C)C4=CC=C(C=C4)OC

DOS

IR

Vibrations