Geometry & MOs

Info

ID:	298664
PubChem CID:	117653722
Reduced:	O2C9H12 (3)
Stoich.:	A2B9C12 (3)
Weight, g/mol:	469.218841
ΔH_f, kcal/mol:	-246.31
Dipole, Da:	4.1
IP(EA), eV:	-8.81(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-bis[2-(dimethylamino)ethyl]-1-methyl-4-[4-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylic acid

Drug info:

PubChemData

Smile

CCC(CC)(C1=CC(=C(C=C1)OCC(=O)OCC)C)C2=CC(=C(C=C2)OCC(=O)OCC)C

DOS

IR

Vibrations