Geometry & MOs

Info

ID:	175801
PubChem CID:	75949694
Reduced:	ClN3O3C23H24 (1)
Stoich.:	AB3C3D23E24 (1)
Weight, g/mol:	296.059269
ΔH_f, kcal/mol:	-12.76
Dipole, Da:	7.06
IP(EA), eV:	-8.54(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-[(2-methoxycarbonylthiophen-3-yl)carbamoyl]-2,2-dimethylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CCN=C2C(C(=O)C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

DOS

IR

Vibrations