Geometry & MOs

Info

ID:	170657
PubChem CID:	75263967
Reduced:	O2N5C15H19 (1)
Stoich.:	A2B5C15D19 (1)
Weight, g/mol:	383.073991
ΔH_f, kcal/mol:	-11.95
Dipole, Da:	12.43
IP(EA), eV:	-9.65(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-fluorophenyl)-N-methyl-N-[(4-oxo-4aH-thieno[3,2-d]pyrimidin-2-yl)methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=NN=C(N2CC1)CCNC(=O)C3C=CC(=O)N=C3

DOS

IR

Vibrations