Geometry & MOs

Info

ID:	130817
PubChem CID:	51113555
Reduced:	ClOSC15H15 (1)
Stoich.:	ABCD15E15 (1)
Weight, g/mol:	310.168128
ΔH_f, kcal/mol:	-3.37
Dipole, Da:	4.16
IP(EA), eV:	-8.57(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[2-(oxolan-2-yl)ethyl]quinoline-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CS(=O)CC2=CC(=CC=C2)Cl

DOS

IR

Vibrations