Geometry & MOs

Info

ID:	131981
PubChem CID:	51285885
Reduced:	O2N3H13C18 (1)
Stoich.:	A2B3C13D18 (1)
Weight, g/mol:	382.169271
ΔH_f, kcal/mol:	36.65
Dipole, Da:	4.9
IP(EA), eV:	-8.83(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-7-fluoro-2-methylquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=C(O1)C=CC(=C2)NC(=O)/C=C/C3=CC=CC=C3C#N

DOS

IR

Vibrations