Geometry & MOs

Info

ID:	31235
PubChem CID:	855298
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-139.7
Dipole, Da:	4.03
IP(EA), eV:	-8.84(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CCC(=O)N(C[C@@H]1CCCO1)CC2=CC3=C(C=C(C=C3NC2=O)C)C

DOS

IR

Vibrations