Geometry & MOs

Info

ID:	81268
PubChem CID:	49854528
Reduced:	O3N4C19H22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	384.125612
ΔH_f, kcal/mol:	-73.93
Dipole, Da:	4.15
IP(EA), eV:	-8.93(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzothiophen-4-yl)-2-(1-methyl-4-morpholin-4-yl-6-oxopyrimidin-2-yl)acetamide

Drug info:

PubChemData

Smile

C[C@H]1CN(C2=CC=CC=C12)C(=O)CC3=NC(=O)C=C(N3)N4CCOCC4

DOS

IR

Vibrations