Geometry & MOs

Info

ID:	177085
PubChem CID:	76133267
Reduced:	ClS2N5O7C22H22 (1)
Stoich.:	AB2C5D7E22F22 (1)
Weight, g/mol:	325.102233
ΔH_f, kcal/mol:	-175.48
Dipole, Da:	4.71
IP(EA), eV:	-9.64(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3,4-dihydroxy-5-(6-oxo-5H-purin-9-yl)oxolan-2-yl]methoxy]-N-methylformamide

Drug info:

PubChemData

Smile

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NS(=O)(=O)N(C(=O)C4=CN=CC=C4)Cl)C(=O)O)C

DOS

IR

Vibrations