Geometry & MOs

Info

ID:	342556
PubChem CID:	127265711
Reduced:	O2N4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	280.096026
ΔH_f, kcal/mol:	7.42
Dipole, Da:	7.38
IP(EA), eV:	-8.73(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-methylpyrazol-3-yl)ethenyl]-6-nitroquinoline

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=N1)C=CC3=NC=C(C(=N3)C(C)C)C(=O)O

DOS

IR

Vibrations