Geometry & MOs

Info

ID:	70859
PubChem CID:	48413965
Reduced:	FON4H17C21 (1)
Stoich.:	ABC4D17E21 (1)
Weight, g/mol:	364.120526
ΔH_f, kcal/mol:	16.86
Dipole, Da:	1.75
IP(EA), eV:	-9.32(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-morpholin-4-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F

DOS

IR

Vibrations