Geometry & MOs

Info

ID:	154896
PubChem CID:	56314444
Reduced:	SN2O2C23H24 (1)
Stoich.:	AB2C2D23E24 (1)
Weight, g/mol:	335.05209
ΔH_f, kcal/mol:	-21.01
Dipole, Da:	3.31
IP(EA), eV:	-9.36(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-methyl-N-(3-phenylbutyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC=CS2)C3=CC=CC=C3

DOS

IR

Vibrations