Geometry & MOs

Info

ID:	142848
PubChem CID:	53100585
Reduced:	O2N5H17C20 (1)
Stoich.:	A2B5C17D20 (1)
Weight, g/mol:	345.122575
ΔH_f, kcal/mol:	34.46
Dipole, Da:	4.65
IP(EA), eV:	-8.48(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-7-oxo-N,1-diphenylpyrazolo[4,3-d]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)C2=NN(C3=C2N=CN(C3=O)C)C4=CC=CC=C4

DOS

IR

Vibrations