Geometry & MOs

Info

ID:	60041
PubChem CID:	26666196
Reduced:	O2N4C23H26 (1)
Stoich.:	A2B4C23D26 (1)
Weight, g/mol:	343.099063
ΔH_f, kcal/mol:	-24.37
Dipole, Da:	5.15
IP(EA), eV:	-9.14(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-2-(3-methylphenoxy)acetamide

Drug info:

PubChemData

Smile

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations