Geometry & MOs

Info

ID:	270827
PubChem CID:	103638337
Reduced:	SBr2N2H10C14 (1)
Stoich.:	AB2C2D10E14 (1)
Weight, g/mol:	322.009825
ΔH_f, kcal/mol:	99.43
Dipole, Da:	2.47
IP(EA), eV:	-9.29(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dichlorothiophen-3-yl)-N-methyl-1-quinolin-8-ylmethanamine

Drug info:

PubChemData

Smile

C1=CC2=C(C=CC(=C2)C(C3=C(SC(=C3)Br)Br)N)N=C1

DOS

IR

Vibrations