Geometry & MOs

Info

ID:	265034
PubChem CID:	103507304
Reduced:	SN3O3C12H17 (1)
Stoich.:	AB3C3D12E17 (1)
Weight, g/mol:	328.091535
ΔH_f, kcal/mol:	-112.34
Dipole, Da:	6.56
IP(EA), eV:	-8.43(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-amino-4-ethylsulfonyl-5-(2-methylprop-2-enylamino)thiophen-2-yl]-cyclopropylmethanone

Drug info:

PubChemData

Smile

CC(=C)CNC1=C(C(=C(S1)C(=O)OC)N)C(=O)NC

DOS

IR

Vibrations