Geometry & MOs

Info

ID:	439304
PubChem CID:	135229073
Reduced:	N5O6C34H53 (1)
Stoich.:	A5B6C34D53 (1)
Weight, g/mol:	388.126019
ΔH_f, kcal/mol:	-277.77
Dipole, Da:	3.54
IP(EA), eV:	-8.38(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(2,6-diaminopurin-9-yl)-2-ethyl-4-methoxyoxolan-3-yl] methyl hydrogen phosphate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC(CCCN1CCN(CC1)CCCN2C=CC=C(C2=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C

DOS

IR

Vibrations