Geometry & MOs

Info

ID:	449250
PubChem CID:	135297167
Reduced:	IO2C8H9 (1)
Stoich.:	AB2C8D9 (1)
Weight, g/mol:	261.194008
ΔH_f, kcal/mol:	-16.63
Dipole, Da:	5.77
IP(EA), eV:	-10.16(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl [(1R,2S,3S)-1-methoxy-3-methyl-2-(methylamino)pentyl] carbonate

Drug info:

PubChemData

Smile

CC1C(C2=C1C(OC2=O)I)C

DOS

IR

Vibrations