Geometry & MOs

Info

ID:	46976
PubChem CID:	10528733
Reduced:	NO2H14C15 (2)
Stoich.:	AB2C14D15 (2)
Weight, g/mol:	480.216141
ΔH_f, kcal/mol:	-117.26
Dipole, Da:	3.02
IP(EA), eV:	-9.03(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(naphthalene-1-carbonylamino)carbamoyl]cyclohexyl]methyl]quinoline-2-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=O)C(=C1O)C(CC3=CC=CC=C3)C4=C(N(C5=CC=CC=C5C4=O)CC)O

DOS

IR

Vibrations