Geometry & MOs

Info

ID:	448974
PubChem CID:	135294928
Reduced:	OPC27H37 (1)
Stoich.:	ABC27D37 (1)
Weight, g/mol:	353.271865
ΔH_f, kcal/mol:	-29.35
Dipole, Da:	5.09
IP(EA), eV:	-8.79(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z,3Z)-6,10-dimethyl-3-[1-(methylamino)ethylidene]-4-methylidene-8-(4-methylphenyl)undec-5-en-2-one

Drug info:

PubChemData

Smile

CCC1=C(C(=C(P1)C)C(=C)/C=C(/C)\CC(CC(C)C)C2=CC=C(C=C2)CC=O)C

DOS

IR

Vibrations