Geometry & MOs

Info

ID:	155909
PubChem CID:	56368260
Reduced:	SO5N6C20H22 (1)
Stoich.:	AB5C6D20E22 (1)
Weight, g/mol:	362.070321
ΔH_f, kcal/mol:	-47.73
Dipole, Da:	6.6
IP(EA), eV:	-9.3(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-chlorophenyl)sulfonylamino]-N-(oxan-2-yloxy)propanamide

Drug info:

PubChemData

Smile

CC1=C(SC2=NC(=NC(=C12)OC)COC)C(=O)N3CCN(CC3)C4=NC=C(C=C4)[N+](=O)[O-]

DOS

IR

Vibrations