Geometry & MOs

Info

ID:	292304
PubChem CID:	114916333
Reduced:	SN2O3H12C13 (1)
Stoich.:	AB2C3D12E13 (1)
Weight, g/mol:	312.114378
ΔH_f, kcal/mol:	-69.2
Dipole, Da:	2.76
IP(EA), eV:	-8.87(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-(2,2-dimethylpropanoylamino)acetyl]amino]-4-methylthiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CSC(=C1NC(=O)C2=CN=CC=C2)C(=O)OC

DOS

IR

Vibrations