Geometry & MOs

Info

ID:	359906
PubChem CID:	127299950
Reduced:	BrON4C16H25 (1)
Stoich.:	ABC4D16E25 (1)
Weight, g/mol:	235.124215
ΔH_f, kcal/mol:	-28.32
Dipole, Da:	1.81
IP(EA), eV:	-9.24(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-1-(oxan-2-yl)methanesulfonamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)CN2CCC(CC2)N3C=C(C=N3)Br

DOS

IR

Vibrations