Geometry & MOs

Info

ID:	123958
PubChem CID:	50867646
Reduced:	FSN2O2C20H23 (1)
Stoich.:	ABC2D2E20F23 (1)
Weight, g/mol:	427.225977
ΔH_f, kcal/mol:	-111.81
Dipole, Da:	7.26
IP(EA), eV:	-8.17(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(1-ethyl-7-methoxy-2,2,4-trimethylquinolin-6-yl)methylideneamino]naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)F)/C=C/3\C(=O)N(C(=O)S3)CC)C(=CC1(C)C)C

DOS

IR

Vibrations