Geometry & MOs

Info

ID:	137203
PubChem CID:	52168955
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	304.132411
ΔH_f, kcal/mol:	-16.6
Dipole, Da:	2.31
IP(EA), eV:	-8.83(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,5-trimethyl-7-naphthalen-2-yloxypyrazolo[4,3-d]pyrimidine

Drug info:

PubChemData

Smile

CC(=C)CN1C(=O)C(=NN(C1=O)CC(=C)C)NCCC2=CC=CC=C2

DOS

IR

Vibrations