Geometry & MOs

Info

ID:	290322
PubChem CID:	104429318
Reduced:	S2N4O5C10H16 (1)
Stoich.:	A2B4C5D10E16 (1)
Weight, g/mol:	314.141262
ΔH_f, kcal/mol:	-124.39
Dipole, Da:	9.6
IP(EA), eV:	-9.69(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-3-[[6-(methylamino)pyridin-3-yl]sulfonylamino]propanamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)CCNS(=O)(=O)C1=CC(=C(S1)N)[N+](=O)[O-]

DOS

IR

Vibrations