Geometry & MOs

Info

ID:	200961
PubChem CID:	79466814
Reduced:	ClSO2N4C11H13 (1)
Stoich.:	ABC2D4E11F13 (1)
Weight, g/mol:	271.087829
ΔH_f, kcal/mol:	-38.97
Dipole, Da:	3.79
IP(EA), eV:	-9.22(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-methoxythiophene-2-carbonyl)amino]-3-methylbutanoate

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC(=C(C=C2)S(=O)(=O)N)N)C)Cl

DOS

IR

Vibrations