Geometry & MOs

Info

ID:	70873
PubChem CID:	48413984
Reduced:	SN4O5C17H22 (1)
Stoich.:	AB4C5D17E22 (1)
Weight, g/mol:	355.108754
ΔH_f, kcal/mol:	-144.35
Dipole, Da:	1.32
IP(EA), eV:	-9.3(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chlorophenyl)methoxy]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations