Geometry & MOs

Info

ID:	318605
PubChem CID:	126652231
Reduced:	ION4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	362.195405
ΔH_f, kcal/mol:	23.78
Dipole, Da:	1.93
IP(EA), eV:	-8.62(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[[(4S,5S)-3-azido-6-ethyl-4,5-dimethyloxan-2-yl]oxymethyl]carbamate

Drug info:

PubChemData

Smile

CC1C(C(=CC1N2C=C(C3=C(N=CN=C32)N)I)CO)C

DOS

IR

Vibrations