Geometry & MOs

Info

ID:	306006
PubChem CID:	125000076
Reduced:	FO2N5C16H20 (1)
Stoich.:	AB2C5D16E20 (1)
Weight, g/mol:	323.105211
ΔH_f, kcal/mol:	-78.43
Dipole, Da:	1.59
IP(EA), eV:	-9.03(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(2R)-oxan-2-yl]pyrimidin-5-yl]methyl]-1H-pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC=CN1CC(=O)NC[C@@]2(CCN(C2)C3=NC=C(C=C3)F)O

DOS

IR

Vibrations