Geometry & MOs

Info

ID:	425941
PubChem CID:	135132917
Reduced:	NO4C21H23 (1)
Stoich.:	AB4C21D23 (1)
Weight, g/mol:	343.06444
ΔH_f, kcal/mol:	-140.73
Dipole, Da:	3.32
IP(EA), eV:	-8.98(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2S,3S)-1-iodo-3-methoxypentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC(=O)C2CCN(CC2)C(=O)OC3=CC=C(C=C3)C

DOS

IR

Vibrations