Geometry & MOs

Info

ID:	129591
PubChem CID:	51073201
Reduced:	SN2O4H16C17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	249.08235
ΔH_f, kcal/mol:	-78.88
Dipole, Da:	5.73
IP(EA), eV:	-8.87(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-methyl-N-(thiophen-2-ylmethyl)furan-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=C(C(=C2)OC)OCCO3)C

DOS

IR

Vibrations