Geometry & MOs

Info

ID:	166402
PubChem CID:	74683812
Reduced:	F3O3N4C23H25 (1)
Stoich.:	A3B3C4D23E25 (1)
Weight, g/mol:	446.192961
ΔH_f, kcal/mol:	-204.91
Dipole, Da:	5.7
IP(EA), eV:	-8.48(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)-1,2,3,5,6,7-hexahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)C2CC3=NC(CC(N3N2)C(F)(F)F)C4=CC=C(C=C4)OC

DOS

IR

Vibrations