Geometry & MOs

Info

ID:	214426
PubChem CID:	84982022
Reduced:	O3N4C23H32 (1)
Stoich.:	A3B4C23D32 (1)
Weight, g/mol:	388.178693
ΔH_f, kcal/mol:	-125.59
Dipole, Da:	4.98
IP(EA), eV:	-8.77(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1-cyclopropylethylamino)-2-oxoethyl] 2-(4-methylphenyl)quinoline-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CN3C(=O)C4CCCCC4C3=O

DOS

IR

Vibrations