Geometry & MOs

Info

ID:	33860
PubChem CID:	7888479
Reduced:	S2N3O3H15C17 (1)
Stoich.:	A2B3C3D15E17 (1)
Weight, g/mol:	382.044585
ΔH_f, kcal/mol:	-56.29
Dipole, Da:	2.45
IP(EA), eV:	-8.96(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)NC(=O)CSC1=NC=NC2=C1C=C(S2)C3=CC=CC=C3

DOS

IR

Vibrations