Geometry & MOs

Info

ID:	395372
PubChem CID:	135025302
Reduced:	NOC23H29 (1)
Stoich.:	ABC23D29 (1)
Weight, g/mol:	271.120843
ΔH_f, kcal/mol:	-4.93
Dipole, Da:	5.46
IP(EA), eV:	-9.21(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-formyl-4-methylquinoline-3-carboxylate

Drug info:

PubChemData

Smile

C/C(=C/C1CCCC1)/C(=C(\C2CCCC2)/OC3=CC=C(C=C3)C#N)/C

DOS

IR

Vibrations