Geometry & MOs

Info

ID:	38038
PubChem CID:	8026541
Reduced:	O2N3C20H25 (1)
Stoich.:	A2B3C20D25 (1)
Weight, g/mol:	392.188212
ΔH_f, kcal/mol:	-34.74
Dipole, Da:	3.05
IP(EA), eV:	-8.64(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(dimethylsulfamoyl)-3,5-dimethylpyrazol-1-yl]-N-[(1S)-1-phenylbutyl]acetamide

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=N3

DOS

IR

Vibrations