Geometry & MOs

Info

ID:	180050
PubChem CID:	76570388
Reduced:	FO2N3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	440.257612
ΔH_f, kcal/mol:	-104.6
Dipole, Da:	3.98
IP(EA), eV:	-8.76(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-N-(2-methyl-1-naphthalen-2-ylpropan-2-yl)-5-phenyl-1,2,3,5,6,7-hexahydropyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1C(NN2C1=NC(CC2(C)C)C3=CC=C(C=C3)F)C

DOS

IR

Vibrations