Geometry & MOs

Info

ID:	312723
PubChem CID:	126607591
Reduced:	OF4N10C30H32 (1)
Stoich.:	AB4C10D30E32 (1)
Weight, g/mol:	383.152144
ΔH_f, kcal/mol:	-57.49
Dipole, Da:	7.5
IP(EA), eV:	-9.02(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[(4-ethenylphenoxy)methoxy]phenyl]-1-methylquinolin-2-one

Drug info:

PubChemData

Smile

C/C=C(\C=C/C(=C)F)/C1=NN(C(=C1C2=NN3C=C(N=C3C=C2)NC(=O)C4=CC(=NC=C4)N)N5CCN(CC5)CCC(F)(F)F)C

DOS

IR

Vibrations