Geometry & MOs

Info

ID:	276585
PubChem CID:	103824392
Reduced:	ClN2O2C14H21 (1)
Stoich.:	AB2C2D14E21 (1)
Weight, g/mol:	271.099063
ΔH_f, kcal/mol:	-84.47
Dipole, Da:	6.41
IP(EA), eV:	-8.55(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2,2-trimethyl-3-[(5-nitrothiophen-3-yl)methylamino]propanamide

Drug info:

PubChemData

Smile

CC(C)(CNCC1=C(C=CC(=C1)Cl)OC)C(=O)NC

DOS

IR

Vibrations