Geometry & MOs

Info

ID:	123724
PubChem CID:	50859770
Reduced:	BrON2C23H25 (1)
Stoich.:	ABC2D23E25 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	24.63
Dipole, Da:	9.37
IP(EA), eV:	-8.02(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(7-methoxy-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylideneamino]-5-nitropyridin-2-amine

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)OC)/C=C(\C#N)/C3=CC(=CC=C3)Br)C)(C)C

DOS

IR

Vibrations