Geometry & MOs

Info

ID:	306272
PubChem CID:	125003451
Reduced:	SO2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	311.105211
ΔH_f, kcal/mol:	-52.75
Dipole, Da:	1.39
IP(EA), eV:	-9.16(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(1,4-dimethylimidazol-2-yl)-4-(1H-pyrazol-4-ylsulfonyl)morpholine

Drug info:

PubChemData

Smile

CC(=O)N1CCC[C@H](C1)C2=C(SC3=C2C=CC=N3)C(=O)N

DOS

IR

Vibrations