Geometry & MOs

Info

ID:	123790
PubChem CID:	50862188
Reduced:	O2N3C24H31 (1)
Stoich.:	A2B3C24D31 (1)
Weight, g/mol:	379.225977
ΔH_f, kcal/mol:	-33.14
Dipole, Da:	9.96
IP(EA), eV:	-7.95(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2E)-2-[(2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl)methylidene]hydrazinyl]benzoic acid

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C=C2)/C=N\NC(=O)C3=CC=CC=C3OC)C(CC1(C)C)C

DOS

IR

Vibrations