Geometry & MOs

Info

ID:	414599
PubChem CID:	135087558
Reduced:	FN2O3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	395.162725
ΔH_f, kcal/mol:	-172.39
Dipole, Da:	7.07
IP(EA), eV:	-9.71(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(=O)N2CC[C@]3(CCCN([C@@H]3C2)C)C(=O)O

DOS

IR

Vibrations