Geometry & MOs

Info

ID:	288119
PubChem CID:	104311736
Reduced:	BrNOC10H10 (1)
Stoich.:	ABCD10E10 (1)
Weight, g/mol:	300.89638
ΔH_f, kcal/mol:	4.58
Dipole, Da:	2.97
IP(EA), eV:	-9.65(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromopyridin-2-yl)-(5-chlorothiophen-2-yl)methanone

Drug info:

PubChemData

Smile

CC(=CC(=O)C1=C(C=CC=N1)Br)C

DOS

IR

Vibrations