Geometry & MOs

Info

ID:	270825
PubChem CID:	103638331
Reduced:	ON2C16H16 (1)
Stoich.:	AB2C16D16 (1)
Weight, g/mol:	397.8911
ΔH_f, kcal/mol:	29.46
Dipole, Da:	3.4
IP(EA), eV:	-9.93(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dibromothiophen-3-yl)-quinolin-8-ylmethanamine

Drug info:

PubChemData

Smile

C1CCC=C(CC1)C(=O)C2=CC3=NC=CN=C3C=C2

DOS

IR

Vibrations