Geometry & MOs

Info

ID:	25467
PubChem CID:	625396
Reduced:	SN4C15H18 (1)
Stoich.:	AB4C15D18 (1)
Weight, g/mol:	355.214744
ΔH_f, kcal/mol:	110.39
Dipole, Da:	11.9
IP(EA), eV:	-8.24(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,7-dimethylocta-2,6-dienyl)-6,7-dimethoxy-2-methyl-1H-quinolin-4-one

Drug info:

PubChemData

Smile

CN(C)C=NC(=S)C(=CC1=CC=C(C=C1)N(C)C)C#N

DOS

IR

Vibrations