Geometry & MOs

Info

ID:	193811
PubChem CID:	78441132
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	368.209993
ΔH_f, kcal/mol:	-86.16
Dipole, Da:	3.37
IP(EA), eV:	-9.37(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(cyclohexylamino)-1-oxopropan-2-yl] 2-ethyl-3-methylquinoline-4-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C1CCCCC1)OC(=O)C2=CC=C(C=C2)C#N

DOS

IR

Vibrations