Geometry & MOs

Info

ID:	282894
PubChem CID:	103944395
Reduced:	OH6N6C11 (1)
Stoich.:	AB6C6D11 (1)
Weight, g/mol:	277.077265
ΔH_f, kcal/mol:	114.17
Dipole, Da:	10.1
IP(EA), eV:	-9.79(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-hydroxy-1-phenylethyl]-4-methoxythiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=NNN=C2)C#N)C#N

DOS

IR

Vibrations