Geometry & MOs

Info

ID:	423536
PubChem CID:	135119692
Reduced:	ON3C9H12 (2)
Stoich.:	AB3C9D12 (2)
Weight, g/mol:	343.171834
ΔH_f, kcal/mol:	5.65
Dipole, Da:	8.66
IP(EA), eV:	-9.08(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-N-[3-[(5-methylpyridin-2-yl)amino]propyl]-1-thiophen-2-ylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)C2=NC(=NO2)CCNC3=NC(=CN=C3)C(=O)N4CCCC4

DOS

IR

Vibrations