Geometry & MOs

Info

ID:	252929
PubChem CID:	103114988
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	301.109627
ΔH_f, kcal/mol:	-13.14
Dipole, Da:	6.68
IP(EA), eV:	-9.64(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethylamino)-N-[(2-methyl-3-nitrophenyl)methyl]ethanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CC2=C(N=NN2CCC3CC3)C(=O)O

DOS

IR

Vibrations