Geometry & MOs

Info

ID:	166532
PubChem CID:	74704358
Reduced:	ON2C13H15 (2)
Stoich.:	AB2C13D15 (2)
Weight, g/mol:	455.184506
ΔH_f, kcal/mol:	-26.71
Dipole, Da:	4.09
IP(EA), eV:	-8.12(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(furan-2-yl)-4-(4-hydroxyphenyl)-2-methyl-N-(5-methylpyridin-2-yl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1CC2=C(C(C(C(=N2)C)C(=O)NC3=NC=C(C=C3)C)C4=CC=C(C=C4)N(C)C)C(=O)C1

DOS

IR

Vibrations