Geometry & MOs

Info

ID:	346558
PubChem CID:	127271062
Reduced:	SO2N3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	364.102768
ΔH_f, kcal/mol:	-37.27
Dipole, Da:	5.41
IP(EA), eV:	-9.44(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(1-methyl-5-oxopyrrolidin-3-yl)propanamide

Drug info:

PubChemData

Smile

CN1CC(CC1=O)NC(=O)C2=CSC(=N2)C3CC3

DOS

IR

Vibrations