Geometry & MOs

Info

ID:	228230
PubChem CID:	87563705
Reduced:	PC17H17 (2)
Stoich.:	AB17C17 (2)
Weight, g/mol:	326.95648
ΔH_f, kcal/mol:	90.58
Dipole, Da:	2.69
IP(EA), eV:	-8.32(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-bromo-3-methoxy-6-thiophen-2-ylpyridine-4-carboxylate

Drug info:

PubChemData

Smile

CCC(CC)C1=C(C=CC1P(C2=CC=CC=C2)C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations