Geometry & MOs

Info

ID:	143367
PubChem CID:	53197466
Reduced:	SO2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	424.156912
ΔH_f, kcal/mol:	-51.6
Dipole, Da:	4.17
IP(EA), eV:	-9.07(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetamidophenyl)-3-cyclohexyl-6-methyl-4-oxothieno[3,2-d]pyrimidine-7-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=C(SC2=C1N=CN(C2=O)C3CC3)C

DOS

IR

Vibrations