Geometry & MOs

Info

ID:	217409
PubChem CID:	85087773
Reduced:	O3C23H36 (1)
Stoich.:	A3B23C36 (1)
Weight, g/mol:	361.078735
ΔH_f, kcal/mol:	-100.44
Dipole, Da:	9.34
IP(EA), eV:	-8.91(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxymethyl dihydrogen phosphate

Drug info:

PubChemData

Smile

CCC(=CCC(C)C1(CCC(C2(C1CC=C(C2C=O)C(=O)C)C)O)C)C

DOS

IR

Vibrations