Geometry & MOs

Info

ID:	264066
PubChem CID:	103424027
Reduced:	ON2S2C12H20 (1)
Stoich.:	AB2C2D12E20 (1)
Weight, g/mol:	314.141262
ΔH_f, kcal/mol:	-59.28
Dipole, Da:	6.64
IP(EA), eV:	-8.18(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-amino-2-[2-(dimethylamino)ethylamino]-5-(dimethylcarbamoyl)thiophene-3-carboxylate

Drug info:

PubChemData

Smile

CCC(CC)NC1=C(C(=C(S1)C(=O)C)N)SC

DOS

IR

Vibrations