Geometry & MOs

Info

ID:	27527
PubChem CID:	821852
Reduced:	ON6H12C16 (1)
Stoich.:	AB6C12D16 (1)
Weight, g/mol:	225.101445
ΔH_f, kcal/mol:	101.93
Dipole, Da:	7.46
IP(EA), eV:	-8.92(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-3-amine

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=NN4C=CC=NC4=N3

DOS

IR

Vibrations