Geometry & MOs

Info

ID:	64475
PubChem CID:	29201140
Reduced:	N3O5C24H27 (1)
Stoich.:	A3B5C24D27 (1)
Weight, g/mol:	296.152478
ΔH_f, kcal/mol:	-165.55
Dipole, Da:	4.62
IP(EA), eV:	-8.3(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCOCC4

DOS

IR

Vibrations