Geometry & MOs

Info

ID:	58515
PubChem CID:	24702195
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	272.113648
ΔH_f, kcal/mol:	-49.29
Dipole, Da:	3.92
IP(EA), eV:	-8.19(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(2,2,2-trifluoroethyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(=O)NCCC1CNC2=CC=CC=C12

DOS

IR

Vibrations