Geometry & MOs

Info

ID:	183556
PubChem CID:	77038981
Reduced:	SO3N4C12H18 (1)
Stoich.:	AB3C4D12E18 (1)
Weight, g/mol:	255.194677
ΔH_f, kcal/mol:	-36.73
Dipole, Da:	5.48
IP(EA), eV:	-9.04(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-1-cyclopropyl-2-hydroxyiminoethyl)-3,4,4-trimethylpentanamide

Drug info:

PubChemData

Smile

C1CC1C(C(=NO)N)NS(=O)(=O)CCC2=CC=CC=N2

DOS

IR

Vibrations