Geometry & MOs

Info

ID:	77426
PubChem CID:	48430234
Reduced:	SN3O5C19H29 (1)
Stoich.:	AB3C5D19E29 (1)
Weight, g/mol:	335.184506
ΔH_f, kcal/mol:	-234.05
Dipole, Da:	6.73
IP(EA), eV:	-8.86(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-[2-[3-(3-methylbutoxy)anilino]-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)NS(=O)(=O)C

DOS

IR

Vibrations