Geometry & MOs

Info

ID:	437929
PubChem CID:	135227324
Reduced:	OF5N5H16C23 (1)
Stoich.:	AB5C5D16E23 (1)
Weight, g/mol:	536.25146
ΔH_f, kcal/mol:	-151.02
Dipole, Da:	5.51
IP(EA), eV:	-9.1(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6Z)-4-(3-bromo-5-tert-butylphenyl)-8-methylimino-11-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)undeca-1,6-dien-6-amine

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC(=C1)C2=CN3C(=NC(=C3C4=C(C5=C(C=C4)NN=C5)F)C(F)(F)F)C=N2)F

DOS

IR

Vibrations