Geometry & MOs

Info

ID:	69592
PubChem CID:	47204993
Reduced:	BrClNO3H13C14 (1)
Stoich.:	ABCD3E13F14 (1)
Weight, g/mol:	278.072513
ΔH_f, kcal/mol:	-78.26
Dipole, Da:	1.39
IP(EA), eV:	-9.3(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(furan-3-ylmethylamino)-1-oxopropan-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=COC=C1)OC2=C(C=C(C=C2)Cl)Br

DOS

IR

Vibrations