Geometry & MOs

Info

ID:	123283
PubChem CID:	50840604
Reduced:	SN6H14C17 (1)
Stoich.:	AB6C14D17 (1)
Weight, g/mol:	430.146347
ΔH_f, kcal/mol:	160.98
Dipole, Da:	7.2
IP(EA), eV:	-8.86(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-oxo-3-phenylthieno[3,2-d]pyrimidin-2-yl)-N-phenylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=NN1C2=CC=CC=C2)C3=NSC(=N3)NC4=CC=CC=C4

DOS

IR

Vibrations