Geometry & MOs

Info

ID:	52062
PubChem CID:	12014844
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	284.188863
ΔH_f, kcal/mol:	17.36
Dipole, Da:	5.72
IP(EA), eV:	-8.04(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,4E,6E,8E)-9-(dimethylamino)-2,4-dimethyl-1-(1-methylpyrrol-3-yl)nona-1,4,6,8-tetraen-3-one

Drug info:

PubChemData

Smile

C/C(=C\C=C\N(C)C)/C(=O)/C(=C/C1=CN(C=C1)C)/C

DOS

IR

Vibrations