Geometry & MOs

Info

ID:	303059
PubChem CID:	124489161
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	189.15175
ΔH_f, kcal/mol:	-3.01
Dipole, Da:	5.52
IP(EA), eV:	-9.38(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-tert-butyl-1,2,3,4-tetrahydroquinoline

Drug info:

PubChemData

Smile

CC(C)N[C@H]1CCN(C1=O)CC2=CC=C(C=C2)C#N

DOS

IR

Vibrations