Geometry & MOs

Info

ID:	38039
PubChem CID:	8026557
Reduced:	SO3N4C19H28 (1)
Stoich.:	AB3C4D19E28 (1)
Weight, g/mol:	382.131091
ΔH_f, kcal/mol:	-97.23
Dipole, Da:	4.28
IP(EA), eV:	-9.41(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-4-morpholin-4-ylsulfonylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CCC[C@@H](C1=CC=CC=C1)NC(=O)CN2C(=C(C(=N2)C)S(=O)(=O)N(C)C)C

DOS

IR

Vibrations