Geometry & MOs

Info

ID:	297754
PubChem CID:	117629232
Reduced:	O2H5C7 (2)
Stoich.:	A2B5C7 (2)
Weight, g/mol:	177.101445
ΔH_f, kcal/mol:	-109.93
Dipole, Da:	4.32
IP(EA), eV:	-9.84(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-methyl-7H-purin-6-amine

Drug info:

PubChemData

Smile

C=CC1=C(C2=CC=CC=C2C=C1C(=O)O)C(=O)O

DOS

IR

Vibrations