Geometry & MOs

Info

ID:	265087
PubChem CID:	103509954
Reduced:	SN2O4C14H22 (1)
Stoich.:	AB2C4D14E22 (1)
Weight, g/mol:	282.140199
ΔH_f, kcal/mol:	-165.24
Dipole, Da:	4.14
IP(EA), eV:	-8.29(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-amino-5-[(2-methoxycyclopentyl)amino]thiophen-2-yl]-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(=C(S1)NC2CCCC2OC)OC)N

DOS

IR

Vibrations