Geometry & MOs

Info

ID:	154010
PubChem CID:	56313370
Reduced:	FN3O4C25H30 (1)
Stoich.:	AB3C4D25E30 (1)
Weight, g/mol:	447.18821
ΔH_f, kcal/mol:	-171.89
Dipole, Da:	5.18
IP(EA), eV:	-9.26(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-dimethyl-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC1CCN(CC1)C(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F

DOS

IR

Vibrations