Geometry & MOs

Info

ID:	310014
PubChem CID:	126572802
Reduced:	FON2C23H23 (1)
Stoich.:	ABC2D23E23 (1)
Weight, g/mol:	427.166269
ΔH_f, kcal/mol:	-44.06
Dipole, Da:	4.34
IP(EA), eV:	-9.54(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-butan-2-yloxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-4-chloro-2,8-dimethylquinoline-7-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)C2=CC(=CC(=C2)C3=CC=C(C=C3)F)C(=O)NC(C)(C)C

DOS

IR

Vibrations