Geometry & MOs

Info

ID:	357195
PubChem CID:	127293699
Reduced:	N2O3C22H30 (1)
Stoich.:	A2B3C22D30 (1)
Weight, g/mol:	328.201159
ΔH_f, kcal/mol:	-169.68
Dipole, Da:	8.39
IP(EA), eV:	-9.38(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(6-aminopurin-9-yl)acetamide

Drug info:

PubChemData

Smile

CC1(CC2=C(C=C(C(=O)N2)C(=O)NC3CCC4CCCCC4C3)C(=O)C1)C

DOS

IR

Vibrations