Geometry & MOs

Info

ID:	349192
PubChem CID:	127274918
Reduced:	SF2N2O4C16H20 (1)
Stoich.:	AB2C2D4E16F20 (1)
Weight, g/mol:	372.139782
ΔH_f, kcal/mol:	-233.11
Dipole, Da:	6.44
IP(EA), eV:	-9.7(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4-difluorophenyl)morpholin-4-yl]-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)methanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CN2CCS(=O)(=O)CC2)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations