Geometry & MOs

Info

ID:	375484
PubChem CID:	131529873
Reduced:	OSN2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	16.36
Dipole, Da:	3.37
IP(EA), eV:	-9.01(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)OC2=CC(=NS2)CN)C

DOS

IR

Vibrations