Geometry & MOs

Info

ID:	306379
PubChem CID:	125011503
Reduced:	SO2N4H16C17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	340.099397
ΔH_f, kcal/mol:	5.8
Dipole, Da:	5.9
IP(EA), eV:	-8.95(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(1-benzothiophen-2-yl)methanone

Drug info:

PubChemData

Smile

C1CO[C@H](CN1C(=O)C2=CC3=CC=CC=C3S2)C4=NC=CN=C4N

DOS

IR

Vibrations