Geometry & MOs

Info

ID:	258928
PubChem CID:	103157455
Reduced:	OSN6C12H14 (1)
Stoich.:	ABC6D12E14 (1)
Weight, g/mol:	228.183778
ΔH_f, kcal/mol:	89.49
Dipole, Da:	5.54
IP(EA), eV:	-9.16(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-cyclopentyl-2-hydroxypropyl)amino]-N-methylpropanamide

Drug info:

PubChemData

Smile

COC(CC1=NN2C(=NN=C2S1)C3=CN=CC=C3)CN

DOS

IR

Vibrations