Geometry & MOs

Info

ID:	404394
PubChem CID:	135066154
Reduced:	NO3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	265.117489
ΔH_f, kcal/mol:	-58.63
Dipole, Da:	2.52
IP(EA), eV:	-8.54(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-hydroxy-6-iminopurin-9-yl)butyl acetate

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)/C=C/CN2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations