Geometry & MOs

Info

ID:	58880
PubChem CID:	24715027
Reduced:	O2N3C17H23 (1)
Stoich.:	A2B3C17D23 (1)
Weight, g/mol:	315.100777
ΔH_f, kcal/mol:	-89.79
Dipole, Da:	4.93
IP(EA), eV:	-8.97(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-diphenylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

Drug info:

PubChemData

Smile

CCCC(=O)N1CCC2(CC1)NC3=C(C=CC=C3C(=O)N2)C

DOS

IR

Vibrations