Geometry & MOs

Info

ID:	419872
PubChem CID:	135109477
Reduced:	ClNO4C20H22 (1)
Stoich.:	ABC4D20E22 (1)
Weight, g/mol:	365.221561
ΔH_f, kcal/mol:	-161.33
Dipole, Da:	2.9
IP(EA), eV:	-9.3(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-2,8-dimethyl-N-[(2-methyl-1H-imidazol-5-yl)methyl]quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CCC[C@@]1(CCN(C[C@@H]1O)C(=O)C2=CC=CC3=C2C=CC=C3Cl)C(=O)O

DOS

IR

Vibrations