Geometry & MOs

Info

ID:	66376
PubChem CID:	46504470
Reduced:	NOC5H5 (4)
Stoich.:	ABC5D5 (4)
Weight, g/mol:	387.194677
ΔH_f, kcal/mol:	-8.93
Dipole, Da:	4.94
IP(EA), eV:	-8.14(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-methyl-N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)-3-phenylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])N4CCCCC4

DOS

IR

Vibrations