Geometry & MOs

Info

ID:	312209
PubChem CID:	126603589
Reduced:	N2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	413.223594
ΔH_f, kcal/mol:	-10.08
Dipole, Da:	1.86
IP(EA), eV:	-9.61(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholin-2-yl]benzenesulfonate

Drug info:

PubChemData

Smile

CCC(C)(C)C1=NC(=NC=C1)C(C)(C)C

DOS

IR

Vibrations