Geometry & MOs

Info

ID:	275127
PubChem CID:	103813930
Reduced:	BrON3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	294.99564
ΔH_f, kcal/mol:	-37.84
Dipole, Da:	7.2
IP(EA), eV:	-9.07(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(aminomethyl)-N-(6-bromopyridin-3-yl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)(C(=O)NC2=CN=C(C=C2)Br)N

DOS

IR

Vibrations