Geometry & MOs

Info

ID:	125490
PubChem CID:	50926146
Reduced:	O2S2N3C19H21 (1)
Stoich.:	A2B2C3D19E21 (1)
Weight, g/mol:	387.107519
ΔH_f, kcal/mol:	-26.04
Dipole, Da:	3.7
IP(EA), eV:	-8.95(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[3-(2-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CSC1=NC2=C(C(=O)N1C3=CC=CC=C3C)SC=C2

DOS

IR

Vibrations