Geometry & MOs

Info

ID:	53528
PubChem CID:	14716451
Reduced:	N3O3C17H17 (1)
Stoich.:	A3B3C17D17 (1)
Weight, g/mol:	390.205576
ΔH_f, kcal/mol:	-52.64
Dipole, Da:	5.6
IP(EA), eV:	-8.5(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)-4-nitrobenzenecarboximidoyl cyanide

Drug info:

PubChemData

Smile

CCOC1=C2C(=C(C=C1)OCC)N3C(=O)C=C(C(=C3N2)C#N)C

DOS

IR

Vibrations