Geometry & MOs

Info

ID:	33969
PubChem CID:	7889076
Reduced:	FOSN4H15C16 (1)
Stoich.:	ABCD4E15F16 (1)
Weight, g/mol:	401.119798
ΔH_f, kcal/mol:	12.3
Dipole, Da:	2.66
IP(EA), eV:	-8.76(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-6-phenylthieno[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)F)C(=O)CSC2=NN=C3N2C=CC=C3

DOS

IR

Vibrations