Geometry & MOs

Info

ID:	169532
PubChem CID:	75117722
Reduced:	SN4O5C17H30 (1)
Stoich.:	AB4C5D17E30 (1)
Weight, g/mol:	375.071134
ΔH_f, kcal/mol:	-248.7
Dipole, Da:	4.45
IP(EA), eV:	-9.31(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5,6-dimethyl-4-oxo-4aH-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-(2-hydroxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)N1CCN(CC1)C(=O)C)NC(=O)NC2CCS(=O)(=O)C2

DOS

IR

Vibrations