Geometry & MOs

Info

ID:	265092
PubChem CID:	103509987
Reduced:	SO2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	326.11227
ΔH_f, kcal/mol:	-54.59
Dipole, Da:	7.73
IP(EA), eV:	-8.14(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-amino-5-[(2-methoxycyclopentyl)amino]-4-methylsulfanylthiophen-2-yl]-cyclopropylmethanone

Drug info:

PubChemData

Smile

CC(C)OC1=C(SC(=C1N)C#N)NC2CCCC2OC

DOS

IR

Vibrations