Geometry & MOs

Info

ID:	70235
PubChem CID:	48409664
Reduced:	SN4O5C18H28 (1)
Stoich.:	AB4C5D18E28 (1)
Weight, g/mol:	353.155098
ΔH_f, kcal/mol:	-163.49
Dipole, Da:	4.6
IP(EA), eV:	-9.28(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-difluorophenoxy)-N-[[1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CCOC)C)CNC(=O)C2=CC=C(O2)S(=O)(=O)NC(C)(C)C

DOS

IR

Vibrations