Geometry & MOs

Info

ID:	70234
PubChem CID:	48409658
Reduced:	O3N4C21H28 (1)
Stoich.:	A3B4C21D28 (1)
Weight, g/mol:	412.178041
ΔH_f, kcal/mol:	-75.68
Dipole, Da:	5.51
IP(EA), eV:	-8.99(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(tert-butylsulfamoyl)-N-[[1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-yl]methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1CC1C(=O)NC2=CC=CC(=C2)C(=O)NCC3=C(N(N=C3C)CCOC)C

DOS

IR

Vibrations