Geometry & MOs

Info

ID:	283023
PubChem CID:	103953579
Reduced:	NSO2C13H19 (1)
Stoich.:	ABC2D13E19 (1)
Weight, g/mol:	310.189257
ΔH_f, kcal/mol:	-74.52
Dipole, Da:	4.01
IP(EA), eV:	-8.6(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-[(2,3-dihydroxyphenyl)methylamino]-2-methylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CSC1CCCC1NCC2=CC(=C(C=C2)O)O

DOS

IR

Vibrations