Geometry & MOs

Info

ID:	131993
PubChem CID:	51288372
Reduced:	FSO2N3C18H18 (1)
Stoich.:	ABC2D3E18F18 (1)
Weight, g/mol:	339.104148
ΔH_f, kcal/mol:	-78.19
Dipole, Da:	2.82
IP(EA), eV:	-9.16(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thieno[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC(C)C(C1=CC=C(C=C1)F)NC(=O)CN2C=NC3=C(C2=O)SC=C3

DOS

IR

Vibrations