Geometry & MOs

Info

ID:	36788
PubChem CID:	8012708
Reduced:	SN2O5C21H24 (1)
Stoich.:	AB2C5D21E24 (1)
Weight, g/mol:	320.116092
ΔH_f, kcal/mol:	-163.09
Dipole, Da:	9.1
IP(EA), eV:	-8.28(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-acetylphenyl)-N-(5-methylpyridin-2-yl)furan-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)NC[C@H]4CCCO4

DOS

IR

Vibrations