Geometry & MOs

Info

ID:	443268
PubChem CID:	135258334
Reduced:	IN2C7H13 (1)
Stoich.:	AB2C7D13 (1)
Weight, g/mol:	376.00324
ΔH_f, kcal/mol:	75.98
Dipole, Da:	2.61
IP(EA), eV:	-9.94(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,5S)-2-(4-amino-5-iodopyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolan-3-ol

Drug info:

PubChemData

Smile

CCCC1(N=N1)CCCI

DOS

IR

Vibrations