Geometry & MOs

Info

ID:	177992
PubChem CID:	76261408
Reduced:	S2N3O3H17C19 (1)
Stoich.:	A2B3C3D17E19 (1)
Weight, g/mol:	373.146013
ΔH_f, kcal/mol:	-8.09
Dipole, Da:	6.64
IP(EA), eV:	-8.6(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(thiophene-2-carbonylamino)phenyl] 5-(2-methylpropyl)pyrazolidine-3-carboxylate

Drug info:

PubChemData

Smile

C1C(NNC1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4=CC=CS4

DOS

IR

Vibrations