Geometry & MOs

Info

ID:	49505
PubChem CID:	11533137
Reduced:	N2O2H13C14 (2)
Stoich.:	A2B2C13D14 (2)
Weight, g/mol:	482.218113
ΔH_f, kcal/mol:	-53.49
Dipole, Da:	5.06
IP(EA), eV:	-8.64(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-(4-propan-2-ylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]-5,6,7,8-tetrahydroquinoline-8-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)C3=NC(=C(N3)C4=CC=CC=N4)C5=CC6=C(C=C5)OCO6

DOS

IR

Vibrations