Geometry & MOs

Info

ID:	264053
PubChem CID:	103421898
Reduced:	SO2N5C12H15 (1)
Stoich.:	AB2C5D12E15 (1)
Weight, g/mol:	294.151433
ΔH_f, kcal/mol:	-18.29
Dipole, Da:	5.14
IP(EA), eV:	-8.51(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-[3-(diethylamino)pyrrolidin-1-yl]-4-methoxythiophene-2-carbonitrile

Drug info:

PubChemData

Smile

COC1=C(SC(=C1N)C(=O)N)N2CCN3C=CN=C3C2

DOS

IR

Vibrations