Geometry & MOs

Info

ID:	129514
PubChem CID:	51072914
Reduced:	ClNSO2C11H14 (1)
Stoich.:	ABCD2E11F14 (1)
Weight, g/mol:	283.043378
ΔH_f, kcal/mol:	-42.76
Dipole, Da:	1.81
IP(EA), eV:	-9.37(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorothiophen-2-yl)methyl]-3-(furan-2-yl)-N-methylpropanamide

Drug info:

PubChemData

Smile

COCC(=O)N(CC=C)CC1=CC=C(S1)Cl

DOS

IR

Vibrations