Geometry & MOs

Info

ID:	263511
PubChem CID:	103374389
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	327.0041
ΔH_f, kcal/mol:	19.18
Dipole, Da:	2.22
IP(EA), eV:	-9.0(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromothiophen-2-yl)-(6-methoxypyridazin-3-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCCC1=CC(=CC=C1)C(C2=NN=C(C=C2)OC)NC

DOS

IR

Vibrations