Geometry & MOs

Info

ID:	142065
PubChem CID:	52975649
Reduced:	ClSN3C16H20 (1)
Stoich.:	ABC3D16E20 (1)
Weight, g/mol:	369.125946
ΔH_f, kcal/mol:	62.05
Dipole, Da:	2.63
IP(EA), eV:	-8.86(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-5-phenylpyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1Cl)NCC2CNNC2C3=CC=CS3

DOS

IR

Vibrations