Geometry & MOs

Info

ID:	156070
PubChem CID:	56369001
Reduced:	BrClN2O3C19H20 (1)
Stoich.:	ABC2D3E19F20 (1)
Weight, g/mol:	375.09462
ΔH_f, kcal/mol:	-69.36
Dipole, Da:	4.18
IP(EA), eV:	-8.52(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-ethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1OC2CCN(CC2)C(=O)C3=C(N=CC(=C3)Br)Cl

DOS

IR

Vibrations